SCHEMBL3149781

SCHEMBL3149781

COCCOCc1ccc2ccc(CN3CCC(NC(=O)c4ccc(OC)cc4)CC3)cc2c1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 3/20 0.72
DRD4 P21917 2/20 0.68
MCHR1 Q99705 15/20 0.67

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
SCHEMBL4246591 0.92 MCHR1 (0.66) CCR3DRD4MCHR1
SCHEMBL4240454 0.92 CCR3 (0.59) CCR3DRD4MCHR1
SCHEMBL4238071 0.92 CCR3 (0.59) CCR3DRD4MCHR1
SCHEMBL4236492 0.91 DRD4 (0.71) DRD4MCHR1
SCHEMBL4246600 0.91 MCHR1 (0.72) CCR3DRD4MCHR1
SCHEMBL3145442 0.90 MCHR1 (0.80) CCR3DRD4MCHR1
Hydrochloric Acid SCHEMBL3149079 0.89 MCHR1 (0.78) CCR3DRD4MCHR1
Bromide SCHEMBL3136407 0.89 MCHR1 (0.78) CCR3DRD4MCHR1
SCHEMBL4236450 0.87 MCHR1 (0.56) CCR3DRD4MCHR1
SCHEMBL4238501 0.86 MCHR1 (0.56) CCR3DRD4MCHR1

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 CCR3 4143/4885DRD4 130/4885MCHR1 1/4885

“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.