SCHEMBL30461533

SCHEMBL30461533

C[Si](C)(C)C#Cc1cc2ncn(C3CC3)c2cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.41
FGFR2 P21802 2/20 0.41
FGFR3 P22607 2/20 0.41
HSD17B10 Q99714 2/20 0.33
CYP17A1 P05093 1/20 0.33
GAA P10253 1/20 0.33
DRD2 P14416 2/20 0.33
IDO1 P14902 2/20 0.33
CYP2C9 P11712 1/20 0.33
KCNH2 Q12809 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
SLC6A4 P31645 1/20 0.33
ALDH1A1 P00352 3/20 0.32
TP53 P04637 1/20 0.32
PGK1 P00558 1/20 0.32
THRB P10828 1/20 0.31
HPGD P15428 2/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31

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
SCHEMBL24463344 1.00 FGFR1 (0.41) FGFR1FGFR2FGFR3HSD17B10CYP17A1
SCHEMBL24463288 0.84 IDO1 (0.39) FGFR1FGFR2FGFR3HSD17B10IDO1
SCHEMBL24463571 0.81 FGFR1 (0.38) FGFR1FGFR2FGFR3HSD17B10CYP17A1
SCHEMBL26790691 0.80 GRM5 (0.39) HSD17B10GAAALDH1A1TP53HPGD
SCHEMBL28995813 0.80 FGFR1 (0.41) FGFR1FGFR2FGFR3HSD17B10CYP17A1
SCHEMBL24463353 0.76 CCNT1 (0.59) ALDH1A1LMNACCNT1CDK9
SCHEMBL30461561 0.76 CCNT1 (0.59) ALDH1A1LMNACCNT1CDK9
SCHEMBL30490119 0.75 GRM5 (0.43) FGFR1FGFR2FGFR3HSD17B10GAA
SCHEMBL25335186 0.75 GRM5 (0.43) FGFR1FGFR2FGFR3HSD17B10GAA
SCHEMBL26791306 0.75 JAK1 (0.30) DRD2DRD4DRD3

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
WO-2023107870-A1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR KINASES KINNATE BIOPHARMA INC. (US) 2023-06-15 WO disclosed