SCHEMBL11303166

SCHEMBL11303166

CCCCCc1ccc(C(=O)O)c(-c2ccccc2)c1C#N

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 4/20 0.43
GRIA2 P42262 2/20 0.43
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
PPARA Q07869 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
PPARG P37231 1/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40
KAT2B Q92831 1/20 0.40
KAT5 Q92993 1/20 0.40
SAE1 Q9UBE0 1/20 0.40
RARB P10826 3/20 0.40
RARA P10276 1/20 0.40
RARG P13631 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39

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
SCHEMBL1640242 0.81 DHFR (0.41)
SCHEMBL8634018 0.80 DHFR (0.43)
SCHEMBL28360757 0.79 GABRP (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL11323683 0.79 RARB (0.49) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL4826258 0.78 BID (0.52) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL10789474 0.78 RARB (0.58) PPARAKAT8PPARGRARBRARA
SCHEMBL11117955 0.77 GCGR (0.51) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL7516259 0.77 TSHR (0.46) GRIA4GRIA2PPARARARBRARA
SCHEMBL6897145 0.74 BID (0.44) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL28565323 0.74 GABRP (0.41) BIDMCL1BCL2L1BAK1PPARA

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
US-4265784-A Azine liquid crystal compounds for use in light-control devices GENERAL ELECTRIC COMPANY (US) 1981-05-05 US claimed