SCHEMBL3145285

SCHEMBL3145285

COc1ccc2cc(CN3CCC(NC(=O)c4ccc(F)c(Cl)c4)CC3)ccc2c1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 13/20 0.72
CCR3 P51677 4/20 0.72
DRD4 P21917 3/20 0.68

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
SCHEMBL3144416 0.91 MCHR1 (0.67) MCHR1CCR3DRD4
SCHEMBL3135668 0.88 MCHR1 (0.66) MCHR1CCR3DRD4
SCHEMBL3144093 0.88 MCHR1 (0.69) MCHR1CCR3DRD4
SCHEMBL3145038 0.85 MCHR1 (0.62) MCHR1CCR3DRD4
SCHEMBL3134114 0.84 MCHR1 (0.90) MCHR1CCR3DRD4
SCHEMBL14290645 0.84 DRD4 (0.61) MCHR1CCR3DRD4
SCHEMBL3153217 0.83 MCHR1 (0.90) MCHR1CCR3DRD4
SCHEMBL14291138 0.81 DRD4 (0.57) MCHR1CCR3DRD4
SCHEMBL3141238 0.81 MCHR1 (0.64) MCHR1CCR3DRD4
SCHEMBL13991076 0.80 MCHR1 (1.00) MCHR1CCR3DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100081825-A1 1-NAPHTHYL ALKYLPIPERIDINE DERIVATIVE TAISHO PHARMACEUTICAL CO LTD (JP) 2010-04-01 US disclosed
EP-2098509-A1 1-NAPHTHYL ALKYLPIPERIDINE DERIVATIVE Taisho Pharmaceutical Co. Ltd. (JP) 2009-09-09 EP 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-20100081825-A1 1-NAPHTHYL ALKYLPIPERIDINE DERIVATIVE MCHR1, MCHR2, MC5R MCHR1 1/4885CCR3 4143/4885DRD4 130/4885

“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.