SCHEMBL7010823

SCHEMBL7010823

CC(CN(C)C)Sc1nc2cc(N3CCNCC3)c(Cl)cc2[nH]1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 20/20 0.70
OPRM1 P35372 6/20 0.56
OPRK1 P41145 6/20 0.56

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 SCHEMBL6484691 0.99 OPRL1 (0.69) OPRL1OPRM1OPRK1
SCHEMBL7010817 0.96 OPRL1 (0.64) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6484688 0.95 OPRL1 (0.63) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6496955 0.84 OPRL1 (0.69) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6494680 0.84 OPRL1 (0.69) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6483307 0.84 OPRL1 (0.69) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6527311 0.84 OPRL1 (0.69) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6483938 0.84 OPRL1 (0.69) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6494542 0.83 OPRL1 (0.67) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6496953 0.82 OPRL1 (0.66) OPRL1OPRM1OPRK1

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
EP-1342717-A1 BENZIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2003-09-10 EP disclosed