SCHEMBL30739337

SCHEMBL30739337

C=Cc1c(-c2ncc(N)cc2C)n(-c2ccc(OCc3ccccc3)c(F)c2)c2c(O)ncnc12

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.32
ERN1 O75460 1/20 0.32
PTGER1 P34995 1/20 0.32
FFAR1 O14842 1/20 0.31
PPARD Q03181 1/20 0.31
S1PR5 Q9H228 1/20 0.30
CYP19A1 P11511 2/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KDR P35968 1/20 0.30
KMT2A Q03164 1/20 0.30
MRGPRX4 Q96LA9 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 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
SCHEMBL29178656 1.00 PDK1 (0.32) PDK1ERN1PTGER1FFAR1PPARD
SCHEMBL29178900 0.90 MRGPRX4 (0.33) PDK1ERN1PTGER1FFAR1PPARD
SCHEMBL30739285 0.90 MRGPRX4 (0.33) PDK1ERN1PTGER1FFAR1PPARD
SCHEMBL30739319 0.85 PTGER1 (0.34) ERN1PTGER1FFAR1PPARDS1PR5
SCHEMBL29178855 0.85 PTGER1 (0.34) ERN1PTGER1FFAR1PPARDS1PR5
SCHEMBL29178795 0.84 LMNA (0.36) MEN1MAPTKMT2A
SCHEMBL29178786 0.82 ERN1 (0.36) ERN1PTGER1CYP19A1MRGPRX4CYP11B1
SCHEMBL30739338 0.82 ERN1 (0.36) ERN1PTGER1CYP19A1MRGPRX4CYP11B1
SCHEMBL30739408 0.81 ERN1 (0.35) ERN1CYP19A1CYP11B1CYP11B2
SCHEMBL29178833 0.81 ERN1 (0.35) ERN1CYP19A1CYP11B1CYP11B2

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-117466897-A Highly selective FGFR2 inhibitors 深圳福沃药业有限公司 2024-01-30 CN disclosed