SCHEMBL3595175

SCHEMBL3595175

O=C1CCN(C2Cc3ccc(F)c4cccc2c34)CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 15/20 0.42
OPRM1 P35372 14/20 0.42
OPRK1 P41145 13/20 0.42
OPRD1 P41143 5/20 0.39
DRD2 P14416 3/20 0.38
HTR1A P08908 2/20 0.38
HTR7 P34969 1/20 0.38
CHRNA7 P36544 1/20 0.36

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
SCHEMBL3595173 1.00 OPRL1 (0.42) OPRL1OPRM1OPRK1OPRD1DRD2
SCHEMBL2245724 0.79 OPRL1 (0.52) OPRL1OPRM1OPRK1OPRD1
SCHEMBL550293 0.79 OPRL1 (0.52) OPRL1OPRM1OPRK1OPRD1
SCHEMBL7883594 0.79 OPRL1 (0.52) OPRL1OPRM1OPRK1OPRD1
SCHEMBL3579279 0.74 OPRM1 (0.61) OPRL1OPRM1OPRK1OPRD1
SCHEMBL3579283 0.74 OPRM1 (0.61) OPRL1OPRM1OPRK1OPRD1
SCHEMBL3582923 0.72 KDM4E (0.41) OPRL1OPRM1OPRK1OPRD1
SCHEMBL3582920 0.72 KDM4E (0.41) OPRL1OPRM1OPRK1OPRD1
SCHEMBL3590810 0.70
SCHEMBL3577943 0.70

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-8877779-B2 Benzimidazole compound and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-11-04 US disclosed
US-20100120841-A1 BENZIMIDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-05-13 US disclosed
EP-2128154-A1 BENZIMIDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2009-12-02 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-20100120841-A1 BENZIMIDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF ORMDL3, OXA1L, OGFRL1 OPRL1 11/4885OPRM1 55/4885OPRK1 133/4885

“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.