SCHEMBL14315765

SCHEMBL14315765

Cc1cccc2cccc(CN3CCC(C4CNc5c(Cl)cccc54)CC3)c12

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 7/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ACHE P22303 2/20 0.38
GNAI3 P08754 1/20 0.35
ALDH1A1 P00352 2/20 0.34
ATM Q13315 1/20 0.34
DRD4 P21917 3/20 0.34
OPRM1 P35372 2/20 0.34
OPRK1 P41145 2/20 0.34
OPRL1 P41146 1/20 0.34

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
SCHEMBL14280683 0.71 OPRM1 (0.57) CXCR4MEN1KMT2AACHEDRD4
SCHEMBL14280698 0.67 OPRL1 (0.76) MEN1KMT2ADRD4OPRM1OPRK1
SCHEMBL15861169 0.65 KMT2A (0.44) MEN1KMT2AACHEALDH1A1ATM
SCHEMBL14280681 0.64 OPRM1 (0.79) MEN1KMT2AALDH1A1OPRM1OPRK1
SCHEMBL17283371 0.62 OPRM1 (0.61) OPRM1OPRK1OPRL1
SCHEMBL4880602 0.62 OPRM1 (0.75) OPRM1OPRK1OPRL1
SCHEMBL14280678 0.62 OPRM1 (0.44) MEN1KMT2AALDH1A1ATMOPRM1
SCHEMBL2598045 0.60 HTR2C (0.41)
SCHEMBL1804818 0.60 HTR2C (0.41)
SCHEMBL1804819 0.60 HTR2C (0.41)

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-20080015214-A1 3-PIPERIDIN-4-YL-INDOLE ORL-1 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2008-01-17 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-20080015214-A1 3-PIPERIDIN-4-YL-INDOLE ORL-1 RECEPTOR MODULATORS OGFRL1, OPRL1, ORMDL3 CXCR4 440/4885MEN1 4352/4885KMT2A 3136/4885

“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.