SCHEMBL4332987

SCHEMBL4332987

Cn1[nH]c(=O)c(Br)c1C(c1ccccc1)N1CCC2(CC1)C(=O)CCN2c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 20/20 0.49
OPRK1 P41145 20/20 0.49
OPRL1 P41146 20/20 0.49
OPRM1 P35372 19/20 0.49

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
SCHEMBL4339366 0.87 OPRK1 (0.49) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4322415 0.85 OPRM1 (0.69) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4318202 0.81 OPRK1 (0.59) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4331690 0.80 OPRM1 (0.43) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4332761 0.79 OPRM1 (0.60) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4329477 0.79 OPRK1 (0.72) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4327424 0.78 OPRK1 (0.55) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4330965 0.78 OPRK1 (0.55) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4331164 0.77 OPRK1 (0.54) OPRD1OPRK1OPRL1OPRM1
SCHEMBL4326527 0.77 OPRK1 (0.54) OPRD1OPRK1OPRL1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069340-A1 Pyrazolone Compounds As Metabotropic Glutamate Receptor Agonists For The Treatment Of Neurological And Psychiatric Disorders ASTRAZENECA AB (SE) 2009-03-12 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 (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-20090069340-A1 Pyrazolone Compounds As Metabotropic Glutamate Receptor Agonists For The Treatment Of Neurological And Psychiatric Disorders GRIN1, GRM1, GRIN3A OPRD1 178/4885OPRK1 169/4885OPRL1 96/4885

“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.