SCHEMBL30249117

SCHEMBL30249117

Cn1cccc(-c2ccc(N)nc2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.41
▸ CREBBP Q92793 1/20 0.41
▸ MKNK1 Q9BUB5 1/20 0.41
▸ MKNK2 Q9HBH9 1/20 0.41
▸ FEN1 P39748 9/20 0.40
▸ ALOX5AP P20292 8/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.39
▸ SYK P43405 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ PIK3CD O00329 1/20 0.39
▸ CCKBR P32239 1/20 0.37

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
SCHEMBL23941731 1.00 BRD4 (0.41) BRD4CREBBPMKNK1MKNK2FEN1
SCHEMBL27250753 0.83 CYP1A2 (0.41) ALOX5APKDM4EALDH1A1HRH3SYK
SCHEMBL27252068 0.81 MEN1 (0.41) ALOX5APHRH3PIK3CDCCKBR
SCHEMBL22241874 0.81 CYP2A6 (0.43) ALOX5APHRH3SYK
SCHEMBL27446419 0.79 HRH3 (0.38) BRD4ALOX5APKDM4EALDH1A1HRH3
SCHEMBL27250757 0.79 ALDH1A1 (0.40) BRD4ALOX5APKDM4EALDH1A1HRH3
SCHEMBL26240869 0.78 CHEK1 (0.46) BRD4KDM4EALDH1A1GAAHRH3
SCHEMBL27252253 0.78 HRH3 (0.38) BRD4CREBBPALOX5APKDM4EALDH1A1
SCHEMBL26953454 0.78 HRH3 (0.38) BRD4ALOX5APKDM4EALDH1A1HRH3
SCHEMBL27446444 0.75 HRH3 (0.37) BRD4ALOX5APKDM4EALDH1A1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4136073-A1 SUBSTITUTED PYRIDINES FOR THE TREATMENT OF INFLAMMATORY DISEASES Gossamer Bio Services, Inc. (US) 2023-02-22 — — EP disclosed
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