SCHEMBL6486955

SCHEMBL6486955

CC(C)(C)OC(=O)N1CCN(c2cc3nc(Cl)[nH]c3cc2Cl)CC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 12/20 0.48
KCNH2 Q12809 5/20 0.48
OPRK1 P41145 6/20 0.47
OPRM1 P35372 5/20 0.47
NAMPT P43490 1/20 0.45
BACE1 P56817 1/20 0.43
SUV39H2 Q9H5I1 2/20 0.43
EGLN1 Q9GZT9 2/20 0.42
MAP4K4 O95819 1/20 0.41

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
SCHEMBL6486948 0.95 NAMPT (0.45) OPRL1KCNH2OPRK1OPRM1NAMPT
SCHEMBL6498317 0.89 OPRL1 (0.47) OPRL1KCNH2OPRK1OPRM1NAMPT
SCHEMBL6498311 0.84 MAP4K4 (0.44) OPRL1KCNH2OPRK1OPRM1NAMPT
SCHEMBL6484396 0.82 OPRL1 (0.46) OPRL1KCNH2OPRK1OPRM1NAMPT
SCHEMBL6495147 0.81 OPRL1 (0.57) OPRL1KCNH2OPRK1OPRM1
SCHEMBL6497547 0.81 OPRL1 (0.51) OPRL1KCNH2OPRK1OPRM1
SCHEMBL6484073 0.80 MAPT (0.55) KCNH2BACE1SUV39H2
SCHEMBL6499134 0.80 OPRL1 (0.57) OPRL1KCNH2OPRK1OPRM1
SCHEMBL6486857 0.79 OPRL1 (0.52) OPRL1KCNH2OPRK1OPRM1
SCHEMBL6495985 0.79 OPRL1 (0.49) OPRL1KCNH2OPRK1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969712-B2 Benzimidazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-11-29 US disclosed
US-20040044056-A1 Benzimidazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-04 US disclosed
EP-1342717-A1 BENZIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2003-09-10 EP 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-20040044056-A1 Benzimidazole derivatives GPR119, OPRL1, INSR OPRL1 2/4885KCNH2 126/4885OPRK1 9/4885

“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.