SCHEMBL21709413

SCHEMBL21709413

CC1(C)OB(c2nc(-c3ccc(-c4ccccc4)cc3)c3ccccc3n2)OC1(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 2/20 0.51
▸ LIPG Q9Y5X9 2/20 0.51
▸ NUDT1 P36639 3/20 0.44
▸ ADORA2A P29274 5/20 0.44
▸ ALDH1A1 P00352 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ ATM Q13315 1/20 0.42
▸ MAPT P10636 4/20 0.41
▸ GAA P10253 1/20 0.41
▸ HPGD P15428 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ DHODH Q02127 1/20 0.40
▸ LMNA P02545 3/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ RAD52 P43351 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ TDP1 Q9NUW8 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
SCHEMBL20104346 0.97 NUDT1 (0.46) LPLLIPGNUDT1ADORA2AALDH1A1
SCHEMBL31683834 0.81 LIPG (0.61) LPLLIPGNUDT1ADORA2AALDH1A1
SCHEMBL17412374 0.81 LIPG (0.61) LPLLIPGNUDT1ADORA2AALDH1A1
SCHEMBL19106655 0.81 LIPG (0.61) LPLLIPGNUDT1ADORA2AALDH1A1
SCHEMBL19106647 0.81 LIPG (0.61) LPLLIPGNUDT1ADORA2AALDH1A1
SCHEMBL23352767 0.81 LIPG (0.61) LPLLIPGNUDT1ADORA2AALDH1A1
SCHEMBL28523446 0.80 ALDH1A1 (0.46) NUDT1ADORA2AALDH1A1MEN1KMT2A
SCHEMBL31644060 0.80 LIPG (0.59) LPLLIPGNUDT1ADORA2AALDH1A1
SCHEMBL19106654 0.80 LIPG (0.59) LPLLIPGNUDT1ADORA2AALDH1A1
SCHEMBL17412355 0.80 LIPG (0.59) LPLLIPGNUDT1ADORA2AALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12415949-B2 Compound, organic electroluminescent device, and display device SK INC. (KR) 2025-09-16 — — US disclosed
US-20210143337-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY DEVICE SK MATERIALS CO., LTD. (KR) 2021-05-13 — — US disclosed
US-20210143337-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY DEVICE SK MATERIALS CO., LTD. (KR) 2021-05-13 — — US disclosed
CN-112262144-A Compound, organic electroluminescent device and display device SK材料有限公司 2021-01-22 — — CN disclosed
US-20200048207-A1 COMPOUNDS WITH ARYLAMINE STRUCTURES MERCK PATENT GMBH (DE) 2020-02-13 — — 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 (3 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-12415949-B2 Compound, organic electroluminescent device, and display device L1CAM, EML4, OCIAD2 LPL 159/4885LIPG 266/4885NUDT1 603/4885
US-20200048207-A1 COMPOUNDS WITH ARYLAMINE STRUCTURES DDT, NAT1, INMT LPL 4565/4885LIPG 3273/4885NUDT1 15/4885
US-20210143337-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY DEVICE L1CAM, EML4, OCIAD2 LPL 159/4885LIPG 266/4885NUDT1 603/4885

“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.

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