SCHEMBL4287740

SCHEMBL4287740

CN(C)[C@@H]1CCN(c2ccc(C(N)=O)cc2)C1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.58
KCNH2 Q12809 1/20 0.49
L3MBTL3 Q96JM7 1/20 0.49
GPR119 Q8TDV5 1/20 0.48
CHRNA7 P36544 1/20 0.46
CHRNA10 Q9GZZ6 1/20 0.46
CHRNA9 Q9UGM1 1/20 0.46
USP2 O75604 1/20 0.44

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
SCHEMBL2636306 1.00 MCHR1 (0.58) MCHR1KCNH2L3MBTL3GPR119CHRNA7
SCHEMBL2636123 0.87 MCHR1 (0.61) MCHR1GPR119CHRNA7CHRNA10CHRNA9
SCHEMBL4578849 0.87 MCHR1 (0.62) MCHR1KCNH2L3MBTL3USP2
SCHEMBL1665871 0.87 MCHR1 (0.62) MCHR1KCNH2L3MBTL3USP2
SCHEMBL4841969 0.85 MCHR1 (0.64) MCHR1
SCHEMBL2636915 0.83 MCHR1 (0.48) MCHR1KCNH2GPR119
SCHEMBL2636418 0.83 MCHR1 (0.47) MCHR1GPR119CHRNA7CHRNA10CHRNA9
SCHEMBL2636598 0.80 MCHR1 (0.44) MCHR1GPR119CHRNA7CHRNA10CHRNA9
SCHEMBL4834388 0.80 MCHR1 (0.53) MCHR1
SCHEMBL14155895 0.80 MCHR1 (0.53) MCHR1L3MBTL3GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822495-B2 Azacyclyl-substituted aryldihydroisoquinolinones, process for their preparation and their use as medicaments SANOFI (FR) 2014-09-02 US disclosed
EP-1987020-B1 AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI SA (FR) 2012-10-03 EP disclosed
US-20090264403-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS (FR) 2009-10-22 US disclosed
EP-1987020-A1 AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS Sanofi-Aventis (FR) 2008-11-05 EP disclosed
WO-2007093364-A1 AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS (DE) 2007-08-23 WO 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-20090264403-A1 NOVEL AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS MCHR1, MRGPRX1, MRGPRX4 MCHR1 1/4885KCNH2 641/4885L3MBTL3 4862/4885

“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.