SCHEMBL14280698

SCHEMBL14280698

Cc1cccc2cccc(CN3CCC(c4c[nH]c5ncccc45)CC3)c12

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 5/20 0.76
OPRM1 P35372 5/20 0.76
OPRK1 P41145 4/20 0.76
CTSS P25774 3/20 0.54
HSD11B1 P28845 2/20 0.50
DRD4 P21917 4/20 0.46
DRD3 P35462 3/20 0.46
DRD2 P14416 2/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HTR7 P34969 2/20 0.42
HTR2A P28223 1/20 0.42
HTR6 P50406 1/20 0.42
CCR2 P41597 1/20 0.42

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
SCHEMBL14280701 0.86 OPRM1 (1.00) OPRL1OPRM1OPRK1CTSSHSD11B1
SCHEMBL14280683 0.81 OPRM1 (0.57) OPRL1OPRM1OPRK1CTSSDRD4
SCHEMBL4880602 0.77 OPRM1 (0.75) OPRL1OPRM1OPRK1HSD11B1DRD2
SCHEMBL14280718 0.76 OPRL1 (0.88) OPRL1OPRM1OPRK1CTSSHSD11B1
SCHEMBL25787927 0.74 OPRL1 (0.65) OPRL1OPRM1OPRK1CTSSHSD11B1
SCHEMBL3256968 0.73 OPRL1 (0.65) OPRL1OPRM1OPRK1CTSSHSD11B1
SCHEMBL14430060 0.73 OPRL1 (0.65) OPRL1OPRM1OPRK1CTSSHSD11B1
SCHEMBL14280697 0.73 OPRL1 (1.00) OPRL1OPRM1OPRK1CTSSHSD11B1
SCHEMBL27780012 0.73 OPRL1 (1.00) OPRL1OPRM1OPRK1CTSSHSD11B1
SCHEMBL14529505 0.72 OPRL1 (0.64) OPRL1OPRM1OPRK1CTSSHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101541765-A 3-piperidin-4-yl-indole ORL-1 receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2009-09-23 CN disclosed
US-20080015214-A1 3-PIPERIDIN-4-YL-INDOLE ORL-1 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-01-17 US disclosed
US-20080015214-A1 3-PIPERIDIN-4-YL-INDOLE ORL-1 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-01-17 US disclosed
WO-2007050381-A2 3-PIPERIDIN-4-YL-INDOLE ORL-1 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-05-03 WO 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-20080015214-A1 3-PIPERIDIN-4-YL-INDOLE ORL-1 RECEPTOR MODULATORS OGFRL1, OPRL1, ORMDL3 OPRL1 2/4885OPRM1 11/4885OPRK1 5/4885

“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.