SCHEMBL8356783

SCHEMBL8356783

CCCCCCCCN(CCCC)C(=O)CCCCCCCNC(=O)Cc1c(C)n(Cc2ccccc2)c2ccc(OC)cc12

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 17/20 0.59
PLA2G1B P04054 1/20 0.56
PTGS2 P35354 3/20 0.54

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
SCHEMBL8356294 0.92 PLA2G2A (0.60) PLA2G2APLA2G1BPTGS2
SCHEMBL8358980 0.88 PLA2G2A (0.66) PLA2G2APLA2G1BPTGS2
SCHEMBL8354408 0.85 PLA2G2A (0.63) PLA2G2APLA2G1BPTGS2
SCHEMBL8645649 0.85 PLA2G2A (0.68) PLA2G2APLA2G1BPTGS2
SCHEMBL8360278 0.85 PTGS2 (0.69) PLA2G2APTGS2
SCHEMBL8356920 0.84 PLA2G2A (0.50) PLA2G2APLA2G1BPTGS2
SCHEMBL8356966 0.84 PLA2G2A (0.49) PLA2G2APLA2G1BPTGS2
SCHEMBL8356782 0.83 PLA2G2A (0.61) PLA2G2APLA2G1B
SCHEMBL8356526 0.82 PLA2G2A (0.49) PLA2G2APLA2G1BPTGS2
SCHEMBL8356418 0.82 PLA2G2A (0.49) PLA2G2APLA2G1BPTGS2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5877202-A Indole derivatives useful to treat estrogen-related neoplasms and disorders AVENTISUB II INC. 1999-03-02 US disclosed
EP-0746544-B1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMA INC (US) 1998-09-09 EP disclosed
EP-0746544-A1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMACEUTICALS INC. (US) 1996-12-11 EP disclosed
WO-1995022524-A1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMACEUTICALS INC. (US) 1995-08-24 WO disclosed