SCHEMBL3411213

SCHEMBL3411213

CN(C)C1(c2ccccc2)CCC2(CC1)CC(C)(C)Cc1c2[nH]c2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 20/20 0.67
OPRL1 P41146 10/20 0.67
OGFRL1 Q5TC84 11/20 0.57
OPRK1 P41145 3/20 0.56
OPRD1 P41143 2/20 0.56

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
SCHEMBL4114262 0.81 OPRM1 (1.00) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL4120301 0.78 OPRM1 (0.66) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL3408893 0.77 OPRM1 (0.65) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL3407854 0.76 OPRM1 (0.64) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL3407442 0.74 OPRM1 (1.00) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL1119598 0.74 OPRM1 (0.82) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL1119831 0.73 OPRM1 (0.86) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL10038853 0.72 OPRM1 (1.00) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL517133 0.72 OPRM1 (1.00) OPRM1OPRL1OGFRL1OPRK1OPRD1
SCHEMBL681593 0.72 OPRM1 (0.65) OPRM1OPRL1OGFRL1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288430-B2 Spiro(5.5)undecane derivatives GRUNENTHAL GMBH (DE) 2012-10-16 US claimed
EP-2257526-B1 SPIRO(5.5)UNDECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2011-12-14 EP claimed
EP-2257526-A1 SPIRO(5.5)UNDECANE DERIVATIVES Grünenthal GmbH (DE) 2010-12-08 EP claimed
WO-2009118169-A1 SPIRO(5.5)UNDECANE DERIVATIVES Grünenthal GmbH (DE) 2009-10-01 WO claimed
US-20090247505-A1 SPIRO(5.5)UNDECANE DERIVATIVES GRUNENTHAL GMBH (DE) 2009-10-01 US claimed
US-8288430-B2 Spiro(5.5)undecane derivatives GRUNENTHAL GMBH (DE) 2012-10-16 US disclosed
US-8288430-B2 Spiro(5.5)undecane derivatives GRUNENTHAL GMBH (DE) 2012-10-16 US disclosed
US-8288430-B2 Spiro(5.5)undecane derivatives GRUNENTHAL GMBH (DE) 2012-10-16 US disclosed
EP-2257526-B1 SPIRO(5.5)UNDECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2011-12-14 EP disclosed
WO-2009118169-A1 SPIRO(5.5)UNDECANE DERIVATIVES Grünenthal GmbH (DE) 2009-10-01 WO disclosed
US-20090247505-A1 SPIRO(5.5)UNDECANE DERIVATIVES GRUNENTHAL GMBH (DE) 2009-10-01 US disclosed
US-20090247505-A1 SPIRO(5.5)UNDECANE DERIVATIVES GRUNENTHAL GMBH (DE) 2009-10-01 US disclosed
US-20090247505-A1 SPIRO(5.5)UNDECANE DERIVATIVES GRUNENTHAL GMBH (DE) 2009-10-01 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-20090247505-A1 SPIRO(5.5)UNDECANE DERIVATIVES OPRL1, OPRD1, OPRM1 OPRM1 3/4885OPRL1 1/4885OGFRL1 5/4885

“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.