SCHEMBL21392572

SCHEMBL21392572

Cc1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccc4c5c(cccc35)-c3ccccc3-4)c3ccccc23)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.51
HTT P42858 1/20 0.51
TSHR P16473 1/20 0.40
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GRIA1 P42261 1/20 0.37
CACNG8 Q8WXS5 1/20 0.37
CACNG2 Q9Y698 1/20 0.37
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HRH3 Q9Y5N1 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL9611842 0.90 MAPK1 (0.56) MAPK1HTTTSHRNR1H2NR1H3
SCHEMBL2604818 0.89 MAPK1 (0.55) MAPK1HTTTSHRNR1H2NR1H3
SCHEMBL26344165 0.89 MAPK1 (0.49) MAPK1HTTTSHRNR1H2NR1H3
SCHEMBL21392603 0.88 KDM4E (0.40) MAPK1HTTTSHRESR1ESR2
SCHEMBL21392553 0.87 ESR1 (0.53) MAPK1HTTESR1ESR2ALDH1A1
SCHEMBL20909099 0.87 MAPK1 (0.55) MAPK1HTTTSHRNR1H2NR1H3
SCHEMBL14499554 0.87 MAPK1 (0.55) MAPK1HTTTSHRNR1H2NR1H3
SCHEMBL26344171 0.87 KDM4E (0.39) MAPK1HTTTSHRESR1ESR2
SCHEMBL9976972 0.86 MAPK1 (0.52) MAPK1HTTTSHRNR1H2NR1H3
SCHEMBL24811911 0.86 ESR1 (0.48) MAPK1HTTESR1ESR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11877509-B2 Organic light-emitting element LG CHEM, LTD. 2024-01-16 US disclosed
US-11877509-B2 Organic light-emitting element LG CHEM, LTD. 2024-01-16 US disclosed
US-20230309380-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2023-09-28 US disclosed
US-20230257356-A1 BENZIMIDAZOLE-SUBSTITUTED FLUORANTHENE COMPOUND, AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG CHEM, LTD. (KR) 2023-08-17 US disclosed
US-20230257356-A1 BENZIMIDAZOLE-SUBSTITUTED FLUORANTHENE COMPOUND, AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG CHEM, LTD. (KR) 2023-08-17 US disclosed
WO-2022010087-A1 COMPOUND, AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING SAME 주식회사 엘지화학 2022-01-13 WO disclosed
US-20190296238-A1 Organic Light-emitting Element LG CHEM, LTD. (KR) 2019-09-26 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 (4 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-20190296238-A1 Organic Light-emitting Element CRY1, CRY2, NR2E3 MAPK1 4606/4885HTT 2428/4885TSHR 2662/4885
US-20230309380-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS PIEZO1, OR10J3, TMEM109 MAPK1 675/4885HTT 2655/4885TSHR 4213/4885
US-11877509-B2 Organic light-emitting element CRY1, CRY2, NR2E3 MAPK1 4606/4885HTT 2428/4885TSHR 2662/4885
US-20230257356-A1 BENZIMIDAZOLE-SUBSTITUTED FLUORANTHENE COMPOUND, AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME FLI1, LEF1, CYP1B1 MAPK1 2055/4885HTT 4256/4885TSHR 3272/4885

“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.