SCHEMBL29330164

SCHEMBL29330164

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

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.40
GALR2 O43603 1/20 0.38
MAOB P27338 1/20 0.36
PRKCQ Q04759 2/20 0.36
MET P08581 1/20 0.36
APP P05067 1/20 0.35
SCN9A Q15858 1/20 0.35
ESR1 P03372 2/20 0.35
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
KCNH2 Q12809 1/20 0.34
BRAF P15056 1/20 0.34
KDR P35968 1/20 0.34
SLC22A12 Q96S37 2/20 0.33
CMA1 P23946 1/20 0.33
AHR P35869 1/20 0.33
TTBK1 Q5TCY1 1/20 0.33
TTBK2 Q6IQ55 1/20 0.33
KCNN3 Q9UGI6 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
SCHEMBL29329217 0.91 TTBK1 (0.41) SYKMAOBPRKCQESR1HTR2A
SCHEMBL29330254 0.91 SYK (0.42) SYKMAOBPRKCQMETESR1
SCHEMBL29330163 0.89 ESR1 (0.42) SYKPRKCQSCN9AESR1KCNH2
SCHEMBL29330032 0.88 SYK (0.42) SYKPRKCQMETAPPESR1
SCHEMBL29329364 0.88 KDR (0.39) SYKPRKCQESR1BRAFKDR
SCHEMBL29330251 0.87 SYK (0.41) SYKPRKCQMETAPPESR1
SCHEMBL29330255 0.87 ESR1 (0.42) SYKPRKCQMETAPPSCN9A
SCHEMBL29329538 0.87 SYK (0.39) SYKPRKCQMETESR1HTR2A
SCHEMBL29329126 0.86 SYK (0.40) SYKPRKCQMETESR1SLC22A12
SCHEMBL24539427 0.86 SYK (0.42) SYKGALR2MAOBPRKCQAPP

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