SCHEMBL6476536

SCHEMBL6476536

CN1C[C@@H]2C[C@H]1CN2Cc1nc2ccccc2n1C1CCN(C2(c3ccccc3)CCCCCC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 16/20 0.44
OPRL1 P41146 14/20 0.44
OPRK1 P41145 13/20 0.44
OPRD1 P41143 10/20 0.44
OGFRL1 Q5TC84 5/20 0.42
CCR5 P51681 1/20 0.39
KCNH2 Q12809 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
SCHEMBL6476524 1.00 OPRM1 (0.44) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL6475420 0.87 OPRM1 (0.44) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL6486624 0.83 CCR5 (0.44) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL6488199 0.83 OPRL1 (0.49) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL7096310 0.79 OPRM1 (0.47) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL7094878 0.77 OPRM1 (0.45) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL7094122 0.77 CYP2D6 (0.52) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL7463493 0.76 OPRM1 (0.50) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL7094475 0.75 OPRM1 (0.49) OPRM1OPRL1OPRK1OPRD1OGFRL1
SCHEMBL7095112 0.75 OPRM1 (0.49) OPRM1OPRL1OPRK1OPRD1OGFRL1

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
US-6861425-B2 Benzimidazole compounds as ORL1-receptor agonists PFIZER, INC. (US) 2005-03-01 US disclosed
US-20020049212-A1 Benzimidazole compounds as ORL1-receptor agonists PFIZER PRODUCTS INC. 2002-04-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020049212-A1 Benzimidazole compounds as ORL1-receptor agonists OPRL1, ORMDL3, OGFRL1 OPRM1 4/4885OPRL1 1/4885OPRK1 8/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.