SCHEMBL5856094

SCHEMBL5856094

CC1(c2ccc(O)cc2)CSc2cc(O)ccc2C1CCCCCCCCCCN(C#N)CCCCCC(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.31

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
SCHEMBL5854000 0.90 STS (0.34) STS
SCHEMBL5857175 0.90 STS (0.34) STS
SCHEMBL5854259 0.90 STS (0.34) STS
SCHEMBL5854573 0.90 STS (0.34) STS
SCHEMBL5854340 0.90 STS (0.34) STS
SCHEMBL5854454 0.85 ESR1 (0.32) STS
SCHEMBL6790752 0.83 LTB4R (0.31) STS
SCHEMBL5854635 0.80 TBXA2R (0.35)
SCHEMBL7262813 0.80 TBXA2R (0.35)
SCHEMBL7258633 0.80 TBXA2R (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7074819-B2 Benzopyran or thiobenzopyran derivatives CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-07-11 US disclosed
US-6645951-B1 Antiestrogens for treating breast cancer CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-11-11 US disclosed