SCHEMBL18232158

SCHEMBL18232158

CC(C)(C)c1nc(-c2ccc3ccccc3c2)c2ccccc2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ADORA1 P30542 1/20 0.40
SRC P12931 2/20 0.40
ABL1 P00519 1/20 0.40
DHODH Q02127 1/20 0.40
NUDT1 P36639 3/20 0.40
LMNA P02545 1/20 0.39
PLA2G1B P04054 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
HTR2B P41595 1/20 0.39
HTR5A P47898 1/20 0.39
AURKA O14965 1/20 0.38
AURKB Q96GD4 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26936075 0.91 ADORA2A (0.39) ADORA2AALDH1A1KDM4ENUDT1LMNA
SCHEMBL22113578 0.90 ADORA2A (0.40) ADORA2AALDH1A1KDM4ENUDT1LMNA
SCHEMBL19866547 0.88 ADORA2A (0.40) ADORA2AALDH1A1KDM4EADORA1SRC
SCHEMBL25817449 0.86 SRC (0.37) ADORA2AADORA1SRCABL1DHODH
SCHEMBL19161273 0.84 MAPT (0.41) ALDH1A1KDM4ESRCABL1DHODH
SCHEMBL18232171 0.84 ADORA2A (0.51) ADORA2AALDH1A1KDM4EDHODHNUDT1
SCHEMBL16520903 0.84 ADORA2A (0.55) ADORA2AALDH1A1KDM4ENUDT1LMNA
SCHEMBL18232159 0.83 ADORA2A (0.46) ADORA2AALDH1A1KDM4ENUDT1LMNA
SCHEMBL24701205 0.83 ADORA2A (0.34) ADORA2AALDH1A1KDM4ESRCABL1
SCHEMBL19162667 0.82 MAPT (0.40) ADORA2AALDH1A1KDM4EADORA1SRC

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11840538-B2 Heterocyclic compounds and organic light emitting device using the same LG CHEM, LTD. (KR) 2023-12-12 US disclosed
US-11725138-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. 2023-08-15 US disclosed
US-11725138-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. 2023-08-15 US disclosed
US-20230192669-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 US disclosed
US-20230192669-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 US disclosed
US-20230134350-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORP. (TW) 2023-05-04 US disclosed
US-20230134350-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORP. (TW) 2023-05-04 US disclosed
US-11641778-B2 Compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2023-05-02 US disclosed
US-11641778-B2 Compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2023-05-02 US disclosed
US-11588115-B2 Nitrogen-containing compound, organic electroluminescent device and electronic apparatus SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-02-21 US disclosed
US-10968230-B2 Spiro-structured compound and organic electronic device comprising same LG CHEM, LTD. 2021-04-06 US disclosed
US-20210040112-A1 HETEROACENE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2021-02-11 US disclosed
US-20200190069-A1 NOVEL HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME LG CHEM, LTD. (KR) 2020-06-18 US disclosed
US-9947878-B2 Organic light-emitting device LG CHEM, LTD. (KR) 2018-04-17 US disclosed
US-20180083198-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-22 US disclosed
US-20180083198-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-22 US disclosed
US-20180047914-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-02-15 US disclosed
US-20170213984-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG CHEM, LTD. (KR) 2017-07-27 US disclosed
US-20170012217-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2017-01-12 US disclosed
US-20160336518-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2016-11-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230192669-A1 COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS ACHE, OR51E2, L1CAM ADORA2A 139/4885ALDH1A1 213/4885KDM4E 3255/4885
US-11641778-B2 Compound and organic light emitting device comprising same CRY1, CYP1A1, CRY2 ADORA2A 3590/4885ALDH1A1 9/4885KDM4E 2728/4885
US-20230134350-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME OR10J3, ODC1, OTC ADORA2A 4779/4885ALDH1A1 220/4885KDM4E 2552/4885
US-20180047914-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, NR2E3 ADORA2A 3115/4885ALDH1A1 242/4885KDM4E 1039/4885
US-20180083198-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME NR2E3, CRY1, ERG ADORA2A 3440/4885ALDH1A1 83/4885KDM4E 2931/4885
US-10968230-B2 Spiro-structured compound and organic electronic device comprising same ESR1, OR10J3, ERG ADORA2A 2820/4885ALDH1A1 200/4885KDM4E 1632/4885
US-11588115-B2 Nitrogen-containing compound, organic electroluminescent device and electronic apparatus NCL, NCLN, NNMT ADORA2A 735/4885ALDH1A1 3230/4885KDM4E 2460/4885
US-11725138-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same OR10J3, ICOSLG, TRPM4 ADORA2A 3008/4885ALDH1A1 684/4885KDM4E 1072/4885
US-11840538-B2 Heterocyclic compounds and organic light emitting device using the same CRY1, CYP1A1, CRY2 ADORA2A 3321/4885ALDH1A1 16/4885KDM4E 3498/4885
US-20200190069-A1 NOVEL HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CRY1, CRY2, CYP1A1 ADORA2A 3048/4885ALDH1A1 18/4885KDM4E 2374/4885
US-20170213984-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME CRY1, NOS1, NOLC1 ADORA2A 4027/4885ALDH1A1 331/4885KDM4E 2743/4885
US-20210040112-A1 HETEROACENE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME HCN1, HCN2, CACNA1F ADORA2A 3038/4885ALDH1A1 2216/4885KDM4E 3762/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.