SCHEMBL17283371

SCHEMBL17283371

Cc1cccc2cccc(CN3CCC(N4C(=O)Cc5ccccc54)CC3)c12

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 15/20 0.61
OPRL1 P41146 14/20 0.61
OPRK1 P41145 14/20 0.61
CTSS P25774 1/20 0.50
HTR2A P28223 1/20 0.47
HTR7 P34969 1/20 0.47
KCNH2 Q12809 1/20 0.46
PLD1 Q13393 1/20 0.46

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
SCHEMBL1862708 0.84 OPRM1 (0.67) OPRM1OPRL1OPRK1CTSSHTR2A
SCHEMBL181682 0.77 OPRM1 (1.00) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL14543172 0.76 OPRM1 (0.71) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL1860312 0.76 OPRM1 (0.74) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL15861172 0.73 OPRM1 (0.51) OPRM1OPRL1OPRK1
SCHEMBL15861190 0.73 OPRM1 (0.49) OPRM1OPRL1OPRK1
SCHEMBL10316251 0.73 OPRM1 (0.69) OPRM1OPRL1OPRK1
SCHEMBL1859464 0.73 OPRL1 (0.86) OPRM1OPRL1OPRK1CTSSHTR2A
SCHEMBL15847796 0.73 OPRL1 (0.46) OPRM1OPRL1
SCHEMBL15861290 0.72 OPRL1 (0.44) OPRM1OPRL1OPRK1

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-20150336928-A1 Heterocyclic Compounds And Methods Of Use Thereof SUNOVION PHARMACEUTICALS INC. 2015-11-26 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-20150336928-A1 Heterocyclic Compounds And Methods Of Use Thereof GRIN2C, COMT, NLN OPRM1 259/4885OPRL1 771/4885OPRK1 295/4885

“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.