SCHEMBL14280687

SCHEMBL14280687

CN(C)CC(O)Cn1cc(C2CCN(CC3CCCCCCC3)CC2)c2cc(F)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 1.00
OPRL1 P41146 3/20 1.00
OPRK1 P41145 2/20 1.00
DRD2 P14416 2/20 0.45
SLC6A4 P31645 2/20 0.45
CNR1 P21554 1/20 0.43
PER2 O15055 10/20 0.41
CRY1 Q16526 8/20 0.41
CRY2 Q49AN0 8/20 0.41
HRH2 P25021 2/20 0.40

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
SCHEMBL14280688 0.79 OPRL1 (0.65) OPRM1OPRL1OPRK1DRD2SLC6A4
SCHEMBL14280689 0.78 OPRM1 (0.64) OPRM1OPRL1OPRK1DRD2SLC6A4
SCHEMBL14280674 0.69 OPRL1 (1.00) OPRM1OPRL1OPRK1DRD2SLC6A4
SCHEMBL14280693 0.69 OPRL1 (1.00) OPRM1OPRL1OPRK1DRD2SLC6A4
SCHEMBL27479306 0.65 HRH2 (0.57) OPRM1OPRL1OPRK1DRD2SLC6A4
SCHEMBL19980708 0.65 OPRM1 (0.48) OPRM1OPRL1OPRK1DRD2SLC6A4
SCHEMBL14529394 0.64 DRD2 (0.50) OPRM1OPRL1OPRK1DRD2SLC6A4
SCHEMBL23745568 0.63 OPRL1 (0.47) OPRM1OPRL1OPRK1CNR1HRH2
Hydrochloric Acid SCHEMBL23721927 0.62 OPRL1 (0.46) OPRM1OPRL1OPRK1CNR1HRH2
SCHEMBL15383994 0.61 PER2 (0.65) PER2CRY1CRY2

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 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.