SCHEMBL9039146

SCHEMBL9039146

CN1CCC(=O)c2ccn(CC=CCCl)c2C1=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PKN2 Q16513 1/20 0.30

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
SCHEMBL9039571 1.00 PKN2 (0.30) PKN2
SCHEMBL9039135 1.00 PKN2 (0.30) PKN2
SCHEMBL9041444 0.80 PTPN1 (0.35)
SCHEMBL6982789 0.79 PTPN1 (0.35)
SCHEMBL9041754 0.78 PTPN1 (0.34)
SCHEMBL9039661 0.77
SCHEMBL6994882 0.74 PTPN1 (0.31)
SCHEMBL9041349 0.73 DRD2 (0.49)
SCHEMBL6989751 0.73 PNMT (0.32)
SCHEMBL6998066 0.71 PTPN1 (0.33)

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-0441349-B1 Pyrroloazepine derivatives SUNTORY LTD (JP) 1996-01-03 EP disclosed
US-5416082-A Antiserotonine agents SUNTORY LIMITED (JP) 1995-05-16 US disclosed
US-5391731-A Useful therapeutics for circulatory diseases SUNTORY LIMITED (JP) 1995-02-21 US disclosed
US-5206239-A Cardiovascular disorders SUNTORY LIMITED (JP) 1993-04-27 US disclosed
EP-0441349-A1 Pyrroloazepine derivatives SUNTORY LIMITED (JP) 1991-08-14 EP disclosed