SCHEMBL3135058

SCHEMBL3135058

COCc1ccc2ccc(CN3CCC(NC(=O)Cc4ccc(Cl)c(Cl)c4)CC3)cc2c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 13/20 0.67
MCHR1 Q99705 2/20 0.58
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CCR3 P51677 1/20 0.52

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
SCHEMBL3148969 0.83 MCHR1 (0.58) SIGMAR1MCHR1CCR3
SCHEMBL4034602 0.82 SIGMAR1 (0.83) SIGMAR1MCHR1MEN1KMT2A
SCHEMBL4034921 0.82 MCHR1 (0.77) SIGMAR1MCHR1MEN1KMT2A
SCHEMBL6389014 0.81 SIGMAR1 (0.81) SIGMAR1MCHR1
SCHEMBL4234608 0.81 MCHR1 (0.69) MCHR1CCR3
SCHEMBL4242788 0.80 DRD4 (0.60) MCHR1CCR3
SCHEMBL7487718 0.80 SIGMAR1 (0.74) SIGMAR1MCHR1MEN1KMT2ACCR3
SCHEMBL4031569 0.79 SIGMAR1 (0.67) SIGMAR1MCHR1MEN1KMT2ACCR3
SCHEMBL3135668 0.79 MCHR1 (0.66) MCHR1CCR3
SCHEMBL4034737 0.79 SIGMAR1 (0.81) SIGMAR1MEN1KMT2ACCR3

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
US-20100081825-A1 1-NAPHTHYL ALKYLPIPERIDINE DERIVATIVE TAISHO PHARMACEUTICAL CO LTD (JP) 2010-04-01 US claimed
EP-2098509-A1 1-NAPHTHYL ALKYLPIPERIDINE DERIVATIVE Taisho Pharmaceutical Co. Ltd. (JP) 2009-09-09 EP claimed
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 SIGMAR1 96/4885MCHR1 1/4885MEN1 1012/4885

“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.