SCHEMBL9036144

SCHEMBL9036144

[CH2]CN1CCCC1CN(C)C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.34
OPRK1 P41145 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
SCHEMBL15473811 0.82 SIGMAR1 (0.36) SIGMAR1OPRK1
SCHEMBL12347386 0.82 SIGMAR1 (0.47) SIGMAR1
SCHEMBL14509624 0.82 SIGMAR1 (0.47) SIGMAR1
SCHEMBL13811411 0.78 S1PR1 (0.39) SIGMAR1
SCHEMBL3704745 0.77
SCHEMBL8434986 0.76 SIGMAR1 (0.43) SIGMAR1OPRK1
SCHEMBL2557418 0.76 SIGMAR1 (0.32) SIGMAR1OPRK1
SCHEMBL12477659 0.74 CARM1 (0.38) SIGMAR1
SCHEMBL13683455 0.74 ARG1 (0.32) SIGMAR1OPRK1
SCHEMBL18878613 0.74 ALDH1A1 (0.39) OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0450066-B1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMA CO LTD (JP) 1996-09-11 EP disclosed
US-5401740-A FOR INHIBITING PLATELET AGGREGATION OTSUKA PHARMACEUTICAL CO. (JP) 1995-03-28 US disclosed
US-5227381-A Anticoagulant OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-13 US disclosed
EP-0450066-A1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-10-09 EP disclosed