SCHEMBL29329367

SCHEMBL29329367

CC(Cc1ccccc1)Oc1cc(C#N)nc(Nc2ccc3cc[nH]c3c2)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 6/20 0.40
MET P08581 1/20 0.35
CYP19A1 P11511 2/20 0.35
SYK P43405 1/20 0.35
GCK P35557 3/20 0.35
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
PRKCD Q05655 2/20 0.34
ESR1 P03372 2/20 0.34
ACACB O00763 1/20 0.33
NOTUM Q6P988 1/20 0.33
RET P07949 1/20 0.33
ABCB1 P08183 1/20 0.33
ABCC1 P33527 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
MAPT P10636 1/20 0.33
SLC2A1 P11166 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL29330345 0.87 PRKCQ (0.38) PRKCQMETSYKPRKCDESR1
SCHEMBL29330430 0.84 PRKCQ (0.43) PRKCQSYKMAPTL3MBTL1
SCHEMBL29330429 0.84 CYP19A1 (0.37) PRKCQMETCYP19A1SYKPRKCD
SCHEMBL29329290 0.83 PRKCQ (0.42) PRKCQMETSYKPRKCDESR1
SCHEMBL29330166 0.83 PRKCQ (0.39) PRKCQSYKGCKPRKCDNOTUM
SCHEMBL29329121 0.82 PRKCQ (0.40) PRKCQMETSYKGCKPRKCD
SCHEMBL29330567 0.82 PRKCQ (0.45) PRKCQSYKPRKCDESR1RET
SCHEMBL29329725 0.80 PRKCQ (0.40) PRKCQMETCYP19A1SYKPRKCD
SCHEMBL29328997 0.80 PRKCQ (0.37) PRKCQSYKPRKCDESR1RET
SCHEMBL29329208 0.79 PRKCQ (0.39) PRKCQMETSYKPRKCDESR1

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