SCHEMBL9433447

SCHEMBL9433447

CCCCCCC=CN1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.45
CNR2 P34972 1/20 0.41
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL9433437 1.00 CNR1 (0.45) CNR1CNR2FAAHTRPV1
SCHEMBL4905418 1.00 CNR1 (0.45) CNR1CNR2FAAHTRPV1
SCHEMBL11813686 0.98 CNR1 (0.43) CNR1CNR2FAAHTRPV1
SCHEMBL4910886 0.98 CNR1 (0.43) CNR1CNR2FAAHTRPV1
SCHEMBL10721656 0.92 CNR1 (0.38) CNR1CNR2
SCHEMBL3304252 0.92 CNR1 (0.38) CNR1CNR2
SCHEMBL11588035 0.86 ALDH1A1 (0.44) CNR1CNR2FAAHTRPV1
SCHEMBL11588031 0.86 ALDH1A1 (0.44) CNR1CNR2FAAHTRPV1
SCHEMBL3308128 0.84 ALDH1A1 (0.37) CNR1CNR2
SCHEMBL1464322 0.84 FAAH (0.43) FAAHTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5367073-A Hydroboration followed by oxidation, intermediates for drugs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1994-11-22 US disclosed