SCHEMBL7589490

SCHEMBL7589490

Oc1ccc(C2=C(c3ccc(OCCCCCSCCCC(F)(F)C(F)(F)F)cc3)c3ccc(O)cc3OC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 20/20 0.47
ESR2 Q92731 19/20 0.47

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
SCHEMBL5855964 0.92 ESR1 (0.45) ESR1ESR2
SCHEMBL5851908 0.82 ESR1 (0.54) ESR1ESR2
SCHEMBL5857193 0.81 ESR1 (0.44) ESR1ESR2
SCHEMBL7061202 0.80 ESR1 (0.33) ESR1ESR2
SCHEMBL5075157 0.79 ESR1 (0.60) ESR1
SCHEMBL5851880 0.79 ESR1 (0.60) ESR1
SCHEMBL5851970 0.78 ESR1 (0.61) ESR1
SCHEMBL243923 0.73 ESR1 (0.54) ESR1ESR2
SCHEMBL7815677 0.73 ESR1 (0.42) ESR1ESR2
SCHEMBL5852021 0.72 ESR1 (0.45) ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944613-B1 BENZOPYRAN DERIVATIVES CHUGAI PHARMACEUTICAL CO LTD (JP) 2002-10-09 EP claimed
EP-0944613-A1 NOVEL BENZOPYRAN DERIVATIVES C & C Research Laboratories (KR) 1999-09-29 EP claimed
WO-1998025916-A1 NOVEL BENZOPYRAN DERIVATIVES C & C RESEARCH LABORATORIES (KR) 1998-06-18 WO claimed
EP-0944613-B1 BENZOPYRAN DERIVATIVES CHUGAI PHARMACEUTICAL CO LTD (JP) 2002-10-09 EP disclosed
US-6153768-A RECEPTOR BLOCKING ANTIESTROGENS HAVING REDUCED SIDE EFFECTS C & C RESEARCH LABORATORIES (KR) 2000-11-28 US disclosed