SCHEMBL14280701

SCHEMBL14280701

c1ccc2c(CN3CCC(c4c[nH]c5ncccc45)CC3)cccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 1.00
OPRL1 P41146 5/20 1.00
OPRK1 P41145 4/20 1.00
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CTSS P25774 3/20 0.53
DRD4 P21917 3/20 0.53
DRD2 P14416 2/20 0.53
DRD3 P35462 2/20 0.53
ACHE P22303 1/20 0.52
HSD11B1 P28845 2/20 0.47
HTR2A P28223 2/20 0.47
HTR1A P08908 1/20 0.47
HTR7 P34969 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
SCHEMBL14280698 0.86 OPRL1 (0.76) OPRM1OPRL1OPRK1MEN1KMT2A
SCHEMBL14280718 0.80 OPRL1 (0.88) OPRM1OPRL1OPRK1CTSSDRD4
SCHEMBL14280695 0.79 OPRM1 (0.65) OPRM1OPRL1OPRK1MEN1KMT2A
SCHEMBL14280710 0.78 OPRM1 (1.00) OPRM1OPRL1OPRK1CTSSDRD4
SCHEMBL14430060 0.77 OPRL1 (0.65) OPRM1OPRL1OPRK1KMT2ACTSS
SCHEMBL14280697 0.77 OPRL1 (1.00) OPRM1OPRL1OPRK1CTSSHSD11B1
SCHEMBL27780012 0.77 OPRL1 (1.00) OPRM1OPRL1OPRK1CTSSHSD11B1
SCHEMBL14280672 0.76 OPRM1 (1.00) OPRM1OPRL1OPRK1MEN1KMT2A
SCHEMBL16719380 0.76 OPRL1 (0.64) OPRM1OPRL1OPRK1KMT2AHSD11B1
SCHEMBL25787927 0.76 OPRL1 (0.65) OPRM1OPRL1OPRK1CTSSHSD11B1

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 OPRM1 11/4885OPRL1 2/4885OPRK1 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.