SCHEMBL832596

SCHEMBL832596

CC(c1ccccc1)c1cccc([C@H](C(=O)O)N2CCC(O)(c3ccccc3)CC2)c1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 20/20 0.59
OPRM1 P35372 18/20 0.59
OPRK1 P41145 18/20 0.59
OPRD1 P41143 16/20 0.58

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
SCHEMBL304322 0.86 OPRL1 (0.72) OPRL1OPRM1OPRK1OPRD1
SCHEMBL2778830 0.86 OPRL1 (0.72) OPRL1OPRM1OPRK1OPRD1
SCHEMBL304093 0.74 OPRL1 (0.75) OPRL1OPRM1OPRK1OPRD1
SCHEMBL541284 0.74 OPRL1 (0.75) OPRL1OPRM1OPRK1OPRD1
SCHEMBL15893381 0.74 OPRL1 (0.64) OPRL1OPRM1OPRK1OPRD1
SCHEMBL2707046 0.73 LMNA (0.63) OPRL1OPRM1OPRK1OPRD1
SCHEMBL303920 0.73 LMNA (0.63) OPRL1OPRM1OPRK1OPRD1
SCHEMBL2842642 0.73 OPRL1 (0.70) OPRL1OPRM1OPRK1OPRD1
SCHEMBL7696081 0.72 OPRL1 (0.73) OPRL1OPRM1OPRK1OPRD1
SCHEMBL628105 0.71 LMNA (0.65) OPRL1OPRM1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143414-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-03-27 US disclosed
US-20110098327-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-04-28 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-20110098327-A1 Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS OPRL1 4248/4885OPRM1 2812/4885OPRK1 2801/4885

“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.