SCHEMBL29318098

SCHEMBL29318098

CP(C)c1ccc(-c2cnc(N)c(NCc3ccc4ncccc4c3)n2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.42
LDHB P07195 1/20 0.42
SYK P43405 3/20 0.41
ATR Q13535 1/20 0.41
MET P08581 8/20 0.41
CDKL5 O76039 1/20 0.41
NPC1 O15118 1/20 0.39
PDPK1 O15530 1/20 0.38
KDR P35968 3/20 0.37
WNT3A P56704 1/20 0.37

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
SCHEMBL22109393 0.86 SYK (0.46) LDHALDHBSYKATRMET
SCHEMBL29318034 0.85 NPC1 (0.40) METNPC1PDPK1KDR
SCHEMBL22109397 0.84 LDHA (0.48) LDHALDHBSYKATRMET
SCHEMBL29314399 0.83 NPC1 (0.35) SYKMETNPC1PDPK1KDR
SCHEMBL29314135 0.82 MET (0.41) LDHALDHBSYKMETCDKL5
SCHEMBL22109643 0.81 ATR (0.40) ATRMETCDKL5
SCHEMBL29314182 0.78 CSF1R (0.45) LDHALDHBMET
SCHEMBL29314357 0.77 NPC1 (0.40) METNPC1PDPK1KDR
SCHEMBL29314644 0.76 LDHA (0.43) LDHALDHBSYKATRMET
SCHEMBL29315094 0.76 ATR (0.40) ATRMET

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
EP-3893872-B1 ORGANOPHOSPHORUS-SUBSTITUTED COMPOUNDS AS C-MET INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA INC (US) 2024-07-17 EP disclosed