SCHEMBL4524622

SCHEMBL4524622

O=C(OCc1ccccc1)N1CCCC1c1ncc(-c2ccccc2)[nH]1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRCP P42785 11/20 0.59
OPRM1 P35372 2/20 0.53
OPRD1 P41143 2/20 0.53
HCRTR1 O43613 1/20 0.52
HCRTR2 O43614 1/20 0.52

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
SCHEMBL12174996 0.97 PRCP (0.61) PRCPOPRM1OPRD1
SCHEMBL12160053 0.97 PRCP (0.61) PRCPOPRM1OPRD1
SCHEMBL12160098 0.97 PRCP (0.61) PRCPOPRM1OPRD1
SCHEMBL2708434 0.93 PRCP (0.55) PRCPOPRM1OPRD1
SCHEMBL12175006 0.93 PRCP (0.55) PRCPOPRM1OPRD1
SCHEMBL205415 0.93 PRCP (0.55) PRCPOPRM1OPRD1
SCHEMBL8749176 0.92 PRCP (0.69) PRCP
SCHEMBL19578040 0.92 PRCP (0.58) PRCPOPRM1OPRD1HCRTR1HCRTR2
SCHEMBL10076571 0.91 PRCP (0.59) PRCPOPRM1OPRD1
SCHEMBL3390193 0.90 PRCP (0.52) PRCP

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-20090318445-A1 PDF INHIBITORS NORVARTIS AG (CH) 2009-12-24 US disclosed
EP-1973898-A1 PDF INHIBITORS Novartis AG (CH) 2008-10-01 EP disclosed
WO-2007077186-A1 PDF INHIBITORS NOVARTIS AG (CH) 2007-07-12 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-20090318445-A1 PDF INHIBITORS PDF, TIMP3, MMP2 PRCP 161/4885OPRM1 4282/4885OPRD1 4141/4885

“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.