SCHEMBL4073261

SCHEMBL4073261

OC1OC2(CCN(Cc3ccccc3)CC2)c2c1cnc(Cl)c2Cl

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.61
OPRM1 P35372 1/20 0.45
OPRD1 P41143 1/20 0.45
OPRK1 P41145 1/20 0.45

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
SCHEMBL4074161 0.80 SIGMAR1 (0.67) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL4077581 0.76 SIGMAR1 (0.51) SIGMAR1
SCHEMBL4072644 0.75 SIGMAR1 (0.74) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL4315635 0.75 SIGMAR1 (0.59) SIGMAR1
SCHEMBL4066653 0.74 SIGMAR1 (0.62) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL3403111 0.64 SIGMAR1 (0.72) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL2360466 0.64 SIGMAR1 (0.72) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL2360468 0.64 SIGMAR1 (0.72) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL25358883 0.64 SIGMAR1 (0.74) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL1966477 0.63 SIGMAR1 (0.61) SIGMAR1OPRM1

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-20090247560-A1 Diaryl ketimine derivative BANYU PHARMACEUTICAL CO., LTD. 2009-10-01 US disclosed
EP-2072519-A1 DIARYL KETIMINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-06-24 EP 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-20090247560-A1 Diaryl ketimine derivative NR0B2, NR2C2, NR3C2 SIGMAR1 1623/4885OPRM1 1328/4885OPRD1 808/4885

“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.