SCHEMBL30690442

SCHEMBL30690442

Cc1ncc(NC(=O)CN2CC3CCC3C2)cc1NC(=O)c1cnc2[nH]c(C3=CCOCC3)cc2c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIT P10721 5/20 0.41
ULK1 O75385 1/20 0.39
BTK Q06187 7/20 0.38
BRD4 O60885 2/20 0.33
CSF1R P07333 1/20 0.33
TAF1 P21675 1/20 0.31
RAF1 P04049 1/20 0.31
BRAF P15056 1/20 0.31
WNT3A P56704 1/20 0.31
ABL1 P00519 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
SCHEMBL30690767 0.90 KIT (0.45) KITULK1BTKWNT3A
SCHEMBL30690690 0.87 KIT (0.43) KITULK1BTKWNT3A
SCHEMBL30690482 0.86 KIT (0.41) KITULK1BTK
SCHEMBL30690542 0.83 KIT (0.39) KITULK1BTKRAF1BRAF
SCHEMBL30690666 0.83 KIT (0.42) KITCSF1RABL1
SCHEMBL30690660 0.80 KIT (0.42) KITCSF1RABL1
SCHEMBL30690513 0.80 KIT (0.42) KITCSF1RABL1
SCHEMBL30690501 0.79 GSK3B (0.45) KITCSF1RABL1
SCHEMBL30690716 0.79 GSK3B (0.45) KITCSF1RABL1
SCHEMBL30690504 0.79 HRH3 (0.39) KIT

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-2023247593-A1 PYRROLOPYRIDINE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2023-12-28 WO claimed