SCHEMBL21179714

SCHEMBL21179714

CC(C)OC(=O)CC1C(=O)N(C2CCN(C)CC2)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 16/20 0.53
OPRK1 P41145 15/20 0.53
OPRL1 P41146 13/20 0.53
NOTUM Q6P988 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 1/20 0.37
AGTR1 P30556 1/20 0.37
CDC25A P30304 1/20 0.37

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
SCHEMBL23034711 0.88 OPRM1 (0.52) OPRM1OPRK1OPRL1CDC25A
SCHEMBL21179783 0.88 OPRM1 (0.54) OPRM1OPRK1OPRL1CDC25A
SCHEMBL20229871 0.88 OPRM1 (0.67) OPRM1OPRK1OPRL1
SCHEMBL20212924 0.87 OPRM1 (0.73) OPRM1OPRK1OPRL1
SCHEMBL20229868 0.87 OPRM1 (0.73) OPRM1OPRK1OPRL1
SCHEMBL20212923 0.87 OPRM1 (0.73) OPRM1OPRK1OPRL1
SCHEMBL21179738 0.86 OPRM1 (0.52) OPRM1OPRK1OPRL1NOTUMCYP1A2
SCHEMBL21179778 0.84 OPRM1 (0.55) OPRM1OPRK1OPRL1CDC25A
SCHEMBL21179718 0.83 OPRM1 (0.53) OPRM1OPRK1OPRL1CDC25A
SCHEMBL21179728 0.80 OPRM1 (0.51) OPRM1OPRK1OPRL1CDC25A

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-10358432-B2 Piperdinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC (US) 2019-07-23 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-10358432-B2 Piperdinyl nociceptin receptor compounds OPRL1, OPRK1, OPRD1 OPRM1 4/4885OPRK1 2/4885OPRL1 1/4885

“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.