SCHEMBL6487149

SCHEMBL6487149

CCC(CC)CCc1nc2cc(Cl)c(N3CCNCC3)cc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 17/20 0.56
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
OPRM1 P35372 4/20 0.41
OPRK1 P41145 4/20 0.41
CACNA1G O43497 1/20 0.38
CACNA1H O95180 1/20 0.38
PRKAG1 P54619 1/20 0.38
PRKAA2 P54646 1/20 0.38
PRKAA1 Q13131 1/20 0.38
PRKAB1 Q9Y478 1/20 0.38

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 SCHEMBL6494778 0.99 OPRL1 (0.55) OPRL1GAAHTTOPRM1OPRK1
SCHEMBL6487157 0.96 OPRL1 (0.62) OPRL1GAAHTTOPRM1OPRK1
Hydrochloric Acid SCHEMBL6494782 0.94 OPRL1 (0.61) OPRL1GAAHTTOPRM1OPRK1
Hydrochloric Acid SCHEMBL6485596 0.88 OPRL1 (0.57) OPRL1GAAHTTOPRM1OPRK1
Hydrochloric Acid SCHEMBL6485605 0.83 OPRL1 (0.63) OPRL1GAAHTTOPRM1OPRK1
Hydrochloric Acid SCHEMBL6486023 0.81 OPRL1 (0.54) OPRL1GAAHTTOPRM1OPRK1
Hydrochloric Acid SCHEMBL6484558 0.80 OPRL1 (0.45) OPRL1GAAHTTOPRM1OPRK1
SCHEMBL6487013 0.79 OPRL1 (0.55) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6485009 0.78 OPRL1 (0.54) OPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL6497040 0.78 OPRL1 (0.59) 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 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 2/4885GAA 1713/4885HTT 1228/4885

“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.