SCHEMBL30978936

SCHEMBL30978936

C=Cc1ccc2c(N)nc3nncn3c2c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ TYMS P04818 1/20 0.34
▸ HRH4 Q9H3N8 1/20 0.32
▸ HTR7 P34969 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ F2R P25116 1/20 0.30
▸ TBK1 Q9UHD2 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
SCHEMBL30979090 0.80 KDM4E (0.39) KDM4ETYMSMAPTSMN1; SMN2ALDH1A1
SCHEMBL30979101 0.80 TOP2A (0.37) KDM4EHRH4MAPTSMN1; SMN2ALDH1A1
SCHEMBL30978941 0.74 MAT2A (0.48) KDM4EHRH4MAPTSMN1; SMN2ALDH1A1
SCHEMBL30979125 0.74 KDM4E (0.34) KDM4EMAPTALDH1A1
SCHEMBL23601270 0.74 STAT3 (0.51) KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL29909841 0.74 STAT3 (0.51) KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL23576806 0.74 MAPT (0.35) KDM4EMAPTSMN1; SMN2
SCHEMBL30961002 0.74 MAPT (0.35) KDM4EMAPTSMN1; SMN2
SCHEMBL29909498 0.73 SMN1; SMN2 (0.46) KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL30978935 0.73 CYP1A1 (0.41) KDM4EMAPTSMN1; SMN2ALDH1A1

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
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 — — CN disclosed
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