SCHEMBL28161593

SCHEMBL28161593

O=C(Cl)c1ccnnc1C(=O)Cl

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ KDM5B Q9UGL1 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.31
▸ ASPH Q12797 1/20 0.31
▸ KDM8 Q8N371 1/20 0.31
▸ HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL10562435 0.78 LMNA (0.35) ALDH1A1ALOX15KDM5BKDM4EHCAR2
SCHEMBL5769273 0.71 KDM4E (0.52) ALDH1A1ALOX15KDM5BKDM4EASPH
SCHEMBL277947 0.70 SMN1; SMN2 (0.35) ALDH1A1KDM5BKDM4EASPHKDM8
SCHEMBL890368 0.70 KDM4E (0.55) ALDH1A1ALOX15KDM4E
SCHEMBL28309038 0.70 SIRT3 (0.38) ALDH1A1KDM5BKDM4E
Hydrochloric Acid SCHEMBL28182285 0.68 KDM4E (0.53) ALDH1A1ALOX15KDM4E
SCHEMBL15303931 0.68 KDM4E (0.46) ALDH1A1ALOX15KDM4EASPHKDM8
SCHEMBL21408746 0.66 P2RX7 (0.46) ALDH1A1KDM5BKDM4E
SCHEMBL4117073 0.65 KDM4E (0.47) ALDH1A1KDM5BKDM4E
SCHEMBL5120006 0.65 KDM4E (0.44) ALDH1A1ALOX15KDM5BKDM4EASPH

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
CN-104892582-B Azetidine as the mek inhibitor for treating proliferative disease 埃克塞利希斯股份有限公司 2019-09-27 — — CN disclosed
CN-109053523-A Azetidine as the mek inhibitor for treating proliferative disease 埃克塞利希斯股份有限公司 2018-12-21 — — CN disclosed
CN-103524392-B As for treating the azetidine of the MEK inhibitor of proliferative disease 埃克塞利希斯股份有限公司 2018-06-01 — — CN disclosed
CN-106986872-A Bromine domain inhibitor 艾伯维公司 2017-07-28 — — CN disclosed
CN-104136435-B bromodomain inhibitors 艾伯维公司 2017-05-10 — — CN disclosed
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