SCHEMBL29329431

SCHEMBL29329431

N#Cc1cc(Oc2ccc(C(F)F)nc2)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.39
PRKCQ Q04759 7/20 0.37
PRKCD Q05655 1/20 0.34
ESR1 P03372 2/20 0.34
APP P05067 1/20 0.34
RET P07949 1/20 0.34
TNF P01375 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
EGFR P00533 2/20 0.33
ABL1 P00519 1/20 0.32
BCR P11274 1/20 0.32
MET P08581 1/20 0.32

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
SCHEMBL29330093 0.85 CHRNA7 (0.41) SYKPRKCQESR1APPABL1
SCHEMBL29330255 0.84 ESR1 (0.42) SYKPRKCQESR1APPRET
SCHEMBL29330251 0.84 SYK (0.41) SYKPRKCQPRKCDESR1APP
SCHEMBL29329432 0.84 PRKCQ (0.38) SYKPRKCQPRKCDESR1RET
SCHEMBL29330032 0.83 SYK (0.42) SYKPRKCQPRKCDESR1APP
SCHEMBL29330567 0.83 PRKCQ (0.45) SYKPRKCQPRKCDESR1RET
SCHEMBL29330161 0.83 ESR1 (0.48) SYKPRKCQPRKCDESR1EGFR
SCHEMBL29330254 0.82 SYK (0.42) SYKPRKCQPRKCDESR1RET
SCHEMBL29330163 0.82 ESR1 (0.42) SYKPRKCQESR1
SCHEMBL29330425 0.82 ESR1 (0.42) SYKPRKCQPRKCDESR1RET

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