SCHEMBL8360565

SCHEMBL8360565

CCCCCCC(NC(=O)Cc1c(C)n(C(=O)c2ccc(Cl)cc2)c2ccc(OC(C)=O)cc12)C(=O)N(C)CCCC

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 17/20 0.59
PTGS1 P23219 2/20 0.55

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
SCHEMBL8354848 0.97 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL8358997 0.93 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL8356646 0.93 PTGS2 (0.49) PTGS2PTGS1
SCHEMBL8353887 0.93 PTGS2 (0.69) PTGS2PTGS1
SCHEMBL8359033 0.92 LMNA (0.49) PTGS2PTGS1
SCHEMBL8353575 0.91 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL8356524 0.89 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL8356739 0.89 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL8359037 0.89 PTGS2 (0.64) PTGS2PTGS1
SCHEMBL8361046 0.88 PTGS2 (0.62) PTGS2PTGS1

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-5877202-A Indole derivatives useful to treat estrogen-related neoplasms and disorders AVENTISUB II INC. 1999-03-02 US claimed
US-5877202-A Indole derivatives useful to treat estrogen-related neoplasms and disorders AVENTISUB II INC. 1999-03-02 US disclosed