SCHEMBL6852479

SCHEMBL6852479

CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NMUR2 Q9GZQ4 6/20 0.54
NMUR1 Q9HB89 6/20 0.54
OPRD1 P41143 9/20 0.51
OPRM1 P35372 5/20 0.51
EPHA2 P29317 2/20 0.47
OPRK1 P41145 1/20 0.47

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
SCHEMBL29871019 0.89 NMUR2 (0.58) NMUR2NMUR1OPRD1OPRM1EPHA2
SCHEMBL31052975 0.89 NMUR2 (0.58) NMUR2NMUR1OPRD1OPRM1EPHA2
SCHEMBL19220694 0.89 OPRD1 (0.50) OPRD1OPRM1OPRK1
SCHEMBL2194079 0.86 OPRD1 (0.49) OPRD1OPRM1OPRK1
SCHEMBL2053622 0.85 OPRD1 (0.53) NMUR2NMUR1OPRD1OPRM1EPHA2
SCHEMBL30393693 0.85 OPRD1 (0.54) OPRD1OPRM1OPRK1
SCHEMBL29610294 0.82 OPRM1 (0.54) OPRD1OPRM1OPRK1
SCHEMBL30198506 0.82 NMUR2 (0.56) NMUR2NMUR1OPRD1OPRM1EPHA2
SCHEMBL30148933 0.82 BDKRB2 (0.58) OPRD1OPRM1
SCHEMBL31467755 0.82 OPRM1 (0.53) OPRD1OPRM1OPRK1

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-10376532-B2 Methods of treating, reducing the incidence of, and/or preventing ischemic events CHIESI FARMACEUTICI, S.P.A. (IT) 2019-08-13 US disclosed
US-9925265-B2 Methods of treating or preventing stent thrombosis CHIESI FARMACEUTICI S.P.A. (IT) 2018-03-27 US disclosed
US-20110112030-A1 METHODS OF TREATING OR PREVENTING STENT THROMBOSIS THE MEDICINES COMPANY (US) 2011-05-12 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 (2 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-20110112030-A1 METHODS OF TREATING OR PREVENTING STENT THROMBOSIS SERPINC1, PLAT, HABP2 NMUR2 1655/4885NMUR1 1136/4885OPRD1 3715/4885
US-10376532-B2 Methods of treating, reducing the incidence of, and/or preventing ischemic events P2RY12, P2RY11, PTAFR NMUR2 1118/4885NMUR1 924/4885OPRD1 3790/4885

“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.