SCHEMBL3590742

SCHEMBL3590742

Nc1ccccc1NC1CCN(C2CC3CCCc4cccc2c43)CC1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 9/20 0.45
OPRM1 P35372 8/20 0.45
OPRK1 P41145 7/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
OPRD1 P41143 1/20 0.39
CHRNA7 P36544 1/20 0.34

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
SCHEMBL3582603 0.83 CHRNA7 (0.52) OPRL1OPRM1OPRK1KDM4EGAA
SCHEMBL3582606 0.83 CHRNA7 (0.52) OPRL1OPRM1OPRK1KDM4EGAA
SCHEMBL3587101 0.75 KDM4E (0.47) OPRL1OPRM1OPRK1KDM4EGAA
SCHEMBL3587098 0.75 KDM4E (0.47) OPRL1OPRM1OPRK1KDM4EGAA
SCHEMBL3595393 0.74 OPRL1 (0.53) OPRL1OPRM1OPRK1OPRD1CHRNA7
SCHEMBL2247469 0.74 OPRL1 (0.48) OPRL1OPRM1OPRK1KDM4EGAA
SCHEMBL2240983 0.74 OPRL1 (0.48) OPRL1OPRM1OPRK1KDM4EGAA
SCHEMBL852361 0.69 KDM4E (0.71) OPRL1OPRM1OPRK1KDM4EGAA
SCHEMBL3582920 0.68 KDM4E (0.41) OPRL1OPRM1OPRK1KDM4EGAA
SCHEMBL3582923 0.68 KDM4E (0.41) OPRL1OPRM1OPRK1KDM4EGAA

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.