SCHEMBL4089692

SCHEMBL4089692

COC(c1c([Si](C)(C)C(C)(C)C)[nH]c2ccccc12)C1CCC(Cc2ccccc2)(N(C)C)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.39
OGFRL1 Q5TC84 1/20 0.39
OPRL1 P41146 3/20 0.33
OPRK1 P41145 1/20 0.33
CTSV O60911 1/20 0.30
CTSL P07711 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL3409372 0.88 OPRM1 (0.41) OPRM1OGFRL1OPRL1OPRK1
SCHEMBL3400611 0.76 OPRM1 (0.39) OPRM1OGFRL1OPRL1OPRK1CTSL
SCHEMBL4095669 0.75 GPR84 (0.40) OPRM1OGFRL1OPRL1OPRK1MEN1
SCHEMBL4096995 0.72 OPRL1 (0.45) OPRM1OGFRL1OPRL1OPRK1
SCHEMBL3402372 0.70 HTR6 (0.34) OPRM1OGFRL1OPRL1OPRK1
SCHEMBL3428388 0.69 OPRM1 (0.33) OPRM1OGFRL1OPRL1OPRK1GAA
SCHEMBL3405060 0.67 OPRM1 (0.32) OPRM1OGFRL1OPRL1OPRK1
SCHEMBL3405079 0.65 OPRM1 (0.41) OPRM1OGFRL1OPRL1OPRK1MEN1
SCHEMBL13503629 0.65 OPRM1 (0.54) OPRM1OGFRL1OPRL1OPRK1MEN1
SCHEMBL733191 0.65 OPRM1 (0.49) OPRM1OGFRL1OPRL1OPRK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254864-B1 SUBSTITUTED 4-AMINOCYCLOHEXANE DERIVATIVES FOR THE TREATMENT OF PAIN GRUENENTHAL GMBH (DE) 2014-05-14 EP claimed
US-20090215725-A1 Substituted 4-aminocyclohexane derivatives GRUNENTHAL GMBH (DE) 2009-08-27 US claimed
EP-2254864-B1 SUBSTITUTED 4-AMINOCYCLOHEXANE DERIVATIVES FOR THE TREATMENT OF PAIN GRUENENTHAL GMBH (DE) 2014-05-14 EP disclosed
US-20090215725-A1 Substituted 4-aminocyclohexane derivatives GRUNENTHAL GMBH (DE) 2009-08-27 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-20090215725-A1 Substituted 4-aminocyclohexane derivatives OPRL1, OPRD1, OPRK1 OPRM1 7/4885OGFRL1 695/4885OPRL1 1/4885

“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.