SCHEMBL29367015

SCHEMBL29367015

COCC(=O)Nc1nccc2c1ccn2-c1nc(-c2cccc(C)n2)nc2[nH]cnc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 12/20 0.37
TGFBR2 P37173 4/20 0.37
ATM Q13315 1/20 0.34
CYP2C9 P11712 2/20 0.33
IKBKB O14920 1/20 0.33
CHUK O15111 1/20 0.33
RET P07949 1/20 0.33
EPHA1 P21709 1/20 0.33
FLT4 P35916 1/20 0.33
KDR P35968 1/20 0.33
EPHB1 P54762 1/20 0.33
PTK6 Q13882 1/20 0.33
TP53 P04637 2/20 0.32
HSD17B10 Q99714 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL23007900 1.00 TGFBR1 (0.37) TGFBR1TGFBR2ATMCYP2C9IKBKB
SCHEMBL23007873 0.93 TGFBR1 (0.35) TGFBR1TGFBR2ROCK1
SCHEMBL29363244 0.91 TGFBR1 (0.39) TGFBR1TGFBR2
SCHEMBL23007895 0.91 TGFBR1 (0.39) TGFBR1TGFBR2
SCHEMBL23007865 0.90 TGFBR1 (0.38) TGFBR1TGFBR2
SCHEMBL29363779 0.90 TGFBR1 (0.38) TGFBR1TGFBR2
SCHEMBL23007899 0.90 TGFBR1 (0.38) TGFBR1TGFBR2
SCHEMBL23007688 0.90 TGFBR1 (0.39) TGFBR1TGFBR2
SCHEMBL23007864 0.90 TGFBR1 (0.35) TGFBR1TGFBR2
SCHEMBL23007878 0.89 TGFBR1 (0.35) TGFBR1TGFBR2

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-113993870-B Imidazo pyrimidine compound containing fused ring group, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-06-13 CN disclosed
CN-113993870-A Imidazo pyrimidine compound containing polycyclic group, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2022-01-28 CN disclosed