SCHEMBL7706447

SCHEMBL7706447

N#CCN1CN(c2ccccc2)C2(CCN(C3CCCCCCCCC3)CC2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 11/20 0.57
OPRK1 P41145 9/20 0.53
OPRM1 P35372 7/20 0.52
OPRD1 P41143 7/20 0.52

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
Hydrochloric Acid SCHEMBL7706367 0.99 OPRL1 (0.56) OPRL1OPRK1OPRM1OPRD1
SCHEMBL14013754 0.89 OPRL1 (0.61) OPRL1OPRK1OPRM1OPRD1
Hydrochloric Acid SCHEMBL7705553 0.85 OPRL1 (0.60) OPRL1OPRK1OPRM1OPRD1
Hydrochloric Acid SCHEMBL7709410 0.84 OPRL1 (0.67) OPRL1OPRK1OPRM1OPRD1
Hydrochloric Acid SCHEMBL7701383 0.84 OPRL1 (0.67) OPRL1OPRK1OPRM1OPRD1
Hydrochloric Acid SCHEMBL7709456 0.83 OPRL1 (0.64) OPRL1OPRK1OPRM1OPRD1
Hydrochloric Acid SCHEMBL7706974 0.83 OPRL1 (0.65) OPRL1OPRK1OPRM1OPRD1
Hydrochloric Acid SCHEMBL7706449 0.83 OPRL1 (0.65) OPRL1OPRK1OPRM1OPRD1
Hydrochloric Acid SCHEMBL7706292 0.82 OPRL1 (0.62) OPRL1OPRK1OPRM1OPRD1
Hydrochloric Acid SCHEMBL7706375 0.82 BDKRB2 (0.54) OPRL1OPRK1OPRM1OPRD1

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
EP-0921125-B1 1,3,8-Triazaspiro[4,5]decan-4-on derivatives HOFFMANN LA ROCHE (CH) 2002-01-30 EP claimed
US-6043366-A USEFUL IN TREATING DISORDERS INVOLVING THE ORPHANIN FQ(A SEVENTEEN AMINO ACID LONG PEPTIDE) RECEPTOR. HOFFMAN-LA ROCHE INC. (US) 2000-03-28 US claimed