SCHEMBL8555904

SCHEMBL8555904

Cc1cc2c(c3c1NC(=O)C3=O)OC(COS(C)(=O)=O)C2

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.33

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
SCHEMBL8560088 0.81 DRD2 (0.30)
SCHEMBL9095310 0.81
SCHEMBL9094602 0.80
SCHEMBL8558415 0.80
SCHEMBL8558219 0.79
SCHEMBL8560065 0.79
SCHEMBL9093732 0.74 ADRB2 (0.35)
SCHEMBL15765212 0.74 SIRT2 (0.32)
SCHEMBL15758828 0.73 EZH2 (0.40)
SCHEMBL23921773 0.72 SIRT2 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0653426-B1 Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same KOWA CO (JP) 1998-07-22 EP disclosed
US-5510366-A INOTROPIC, ANTIARRHYMTHMIA AGENTS, VASODILATORS KOWA CO., LTD. (JP) 1996-04-23 US disclosed
EP-0653426-A1 Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same KOWA COMPANY, LTD. (JP) 1995-05-17 EP disclosed