SCHEMBL29330167

SCHEMBL29330167

N#Cc1cc(OCCc2ccccc2Cl)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 8/20 0.39
SIRT2 Q8IXJ6 1/20 0.37
PRKCD Q05655 2/20 0.37
CHEK1 O14757 2/20 0.35
SYK P43405 2/20 0.34
CDK1 P06493 2/20 0.34
KDR P35968 2/20 0.34
ALOX5AP P20292 1/20 0.33
MAPT P10636 1/20 0.33
ESR1 P03372 1/20 0.33
LYN P07948 1/20 0.33
NOTUM Q6P988 1/20 0.33
RET P07949 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
SCHEMBL29329290 0.87 PRKCQ (0.42) PRKCQPRKCDSYKCDK1KDR
SCHEMBL29330026 0.86 SIRT2 (0.40) PRKCQSIRT2PRKCDSYKESR1
SCHEMBL29328815 0.84 MAOB (0.40) PRKCQSIRT2PRKCDCHEK1SYK
SCHEMBL29328881 0.83 SYK (0.38) PRKCQPRKCDSYKCDK1KDR
SCHEMBL29329785 0.83 SYK (0.39) PRKCQPRKCDSYKESR1RET
SCHEMBL29329365 0.82 MET (0.40) PRKCQPRKCDSYKCDK1KDR
SCHEMBL29330430 0.82 PRKCQ (0.43) PRKCQSIRT2SYKMAPT
SCHEMBL29330563 0.81 PRKCQ (0.39) PRKCQSIRT2PRKCDSYKESR1
SCHEMBL29329726 0.81 SYK (0.39) PRKCQPRKCDSYKCDK1KDR
SCHEMBL29329867 0.81 PRKCQ (0.40) PRKCQSIRT2PRKCDSYKCDK1

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