SCHEMBL29903145

SCHEMBL29903145

Cc1cccc(-n2cccc(N)c2=O)n1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.46
GAA P10253 1/20 0.42
TGFBR1 P36897 3/20 0.41
NOS3 P29474 1/20 0.40
NOS2 P35228 1/20 0.40
ALOX5 P09917 2/20 0.39
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
ALDH1A1 P00352 1/20 0.38
IRAK4 Q9NWZ3 3/20 0.36
KDM4E B2RXH2 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
SCHEMBL16812415 1.00 RECQL (0.46) RECQLGAATGFBR1NOS3NOS2
SCHEMBL30452693 0.81 ALOX5 (0.39) ALOX5ALDH1A1KDM4E
SCHEMBL16812408 0.81 ALOX5 (0.39) ALOX5ALDH1A1KDM4E
SCHEMBL16812406 0.78 TYK2 (0.47)
SCHEMBL21258495 0.78 TYK2 (0.46) RECQLGAATGFBR1ALOX5HTR3E
SCHEMBL25952069 0.78 RECQL (0.44) RECQLGAATGFBR1ALOX5HTR3E
SCHEMBL16812433 0.78 IRAK4 (0.37) IRAK4
SCHEMBL16812411 0.78 TYK2 (0.51)
SCHEMBL30452728 0.77 TYK2 (0.36) ALDH1A1KDM4E
SCHEMBL16794599 0.77 TYK2 (0.36) ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115038705-B 7- (Methylamino) pyrazolo [1,5-a ] pyrimidine-3-carboxamide compounds 伊莱利利公司 2024-11-08 CN disclosed
CN-115038705-A 7- (methylamino) pyrazolo [1,5-a ] pyrimidine-3-carboxamide compounds 伊莱利利公司 2022-09-09 CN disclosed