SCHEMBL14501898

SCHEMBL14501898

Cc1ccc(CO)c2c1[C@]13CCN(C)[C@H](C)C1C=CC(O)[C@@H]3O2

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 8/20 0.49
OPRM1 P35372 6/20 0.49
OPRK1 P41145 4/20 0.49
MRGPRX2 Q96LB1 4/20 0.49
SLC22A1 O15245 1/20 0.49
ADRA2A P08913 1/20 0.49
ARRB1 P49407 1/20 0.49
ADRB1 P08588 1/20 0.47
PDE4D Q08499 1/20 0.47
PDE3A Q14432 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
SCHEMBL13151540 0.86 OPRM1 (0.66) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL12283963 0.86 OPRM1 (0.66) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL18867761 0.86 OPRM1 (0.66) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL19880922 0.86 OPRM1 (0.66) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL13656808 0.83 OPRM1 (0.67) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL14463456 0.83 OPRM1 (0.67) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL18867882 0.83 OPRM1 (0.67) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL13668804 0.83 OPRM1 (0.67) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL13181328 0.80 OPRD1 (0.76) OPRD1OPRM1OPRK1MRGPRX2SLC22A1
SCHEMBL14012715 0.80 OPRD1 (0.76) OPRD1OPRM1OPRK1MRGPRX2SLC22A1

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-20070142628-A1 6-Monoacetylmorphine derivatives useful in immunoassay ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2007-06-21 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-20070142628-A1 6-Monoacetylmorphine derivatives useful in immunoassay OPRM1, MAG, IL6ST OPRD1 67/4885OPRM1 1/4885OPRK1 24/4885

“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.