SCHEMBL29328660

SCHEMBL29328660

N#Cc1cc(Oc2ccc(C(F)(F)F)c(F)c2)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.39
CHRNA7 P36544 1/20 0.38
KCNH2 Q12809 1/20 0.38
KDR P35968 9/20 0.37
MET P08581 1/20 0.35
PRKCQ Q04759 2/20 0.35
BRAF P15056 5/20 0.35
ESR1 P03372 2/20 0.34
ABL1 P00519 1/20 0.34
BCR P11274 1/20 0.34
CDK1 P06493 1/20 0.34
ULK1 O75385 1/20 0.33

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
SCHEMBL29329538 0.93 SYK (0.39) SYKKCNH2KDRMETPRKCQ
SCHEMBL29329364 0.90 KDR (0.39) SYKKDRPRKCQBRAFESR1
SCHEMBL29330254 0.89 SYK (0.42) SYKMETPRKCQESR1
SCHEMBL29330032 0.88 SYK (0.42) SYKMETPRKCQESR1ABL1
SCHEMBL29329126 0.87 SYK (0.40) SYKMETPRKCQESR1ABL1
SCHEMBL24539421 0.86 SYK (0.41) SYKCHRNA7KCNH2PRKCQESR1
SCHEMBL29330248 0.86 ESR1 (0.46) SYKCHRNA7KCNH2KDRPRKCQ
SCHEMBL29746074 0.86 SYK (0.41) SYKCHRNA7KCNH2PRKCQESR1
SCHEMBL29330251 0.85 SYK (0.41) SYKMETPRKCQESR1ABL1
SCHEMBL29330255 0.85 ESR1 (0.42) SYKKCNH2METPRKCQESR1

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-2024151919-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2024-07-18 WO disclosed