SCHEMBL4550229

SCHEMBL4550229

O=C(Cn1c(=O)c(=O)n(C2CCN(C3CCCCCCC3)CC2)c2ccccc21)C1CO1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 10/20 0.67
OPRM1 P35372 16/20 0.63
OPRK1 P41145 13/20 0.63
OPRD1 P41143 10/20 0.63
OGFRL1 Q5TC84 11/20 0.51

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
SCHEMBL10216364 0.85 OPRL1 (0.74) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL1270574 0.82 OPRL1 (0.72) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL4546408 0.81 OPRL1 (0.71) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL12028178 0.80 OPRL1 (0.77) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL1271715 0.80 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL551174 0.77 OPRM1 (1.00) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL1270541 0.75 OPRL1 (0.65) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL1272240 0.74 OPRL1 (0.61) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL3612375 0.69 OPRM1 (0.61) OPRL1OPRM1OPRK1OPRD1OGFRL1
SCHEMBL1861746 0.68 OPRL1 (0.57) OPRL1OPRM1OPRK1OPRD1OGFRL1

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-20120108575-A1 HETEROCYCLIC-SUBSTITUTED PIPERIDINE COMPOUNDS AND THE USES THEREOF SHIONOGI & CO., LTD. (JP) 2012-05-03 US disclosed
WO-2008089201-A2 HETEROCYCLIC-SUBSTITUTED PIPERIDINE AS ORL-1 LIGANDS PURDUE PHARMA L.P. (US) 2008-07-24 WO 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-20120108575-A1 HETEROCYCLIC-SUBSTITUTED PIPERIDINE COMPOUNDS AND THE USES THEREOF TRPV1, P2RX4, TRPA1 OPRL1 6/4885OPRM1 17/4885OPRK1 9/4885

“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.