SCHEMBL6463528

SCHEMBL6463528

CN(C)c1cc(NC2CCC(NC(=O)c3cc(Cl)sc3Cl)CC2)nc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.49
MCHR1 Q99705 11/20 0.48
ADRA2A P08913 9/20 0.48
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
RXFP1 Q9HBX9 2/20 0.44
MAPT P10636 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA1A P35348 1/20 0.44
HRH1 P35367 1/20 0.44
HTR2B P41595 1/20 0.44
NPY5R Q15761 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
SCHEMBL6461330 1.00 RAB9A (0.49) RAB9AMCHR1ADRA2AGAAKMT2A
SCHEMBL6456374 0.88 ACACB (0.47) MCHR1ADRA2ANPY5R
SCHEMBL6456370 0.88 ACACB (0.47) MCHR1ADRA2ANPY5R
SCHEMBL27651773 0.87 MCHR1 (0.52) RAB9AMCHR1ADRA2AGAAKMT2A
SCHEMBL6460413 0.87 MCHR1 (0.48) RAB9AMCHR1ADRA2AKMT2AMAPT
SCHEMBL6467599 0.87 MCHR1 (0.48) RAB9AMCHR1ADRA2AKMT2AMAPT
SCHEMBL6879263 0.86 MCHR1 (0.47) RAB9AMCHR1ADRA2AHTR1AADRA1A
SCHEMBL6879261 0.86 MCHR1 (0.47) RAB9AMCHR1ADRA2AHTR1AADRA1A
SCHEMBL6877534 0.84 MCHR1 (0.53) RAB9AMCHR1ADRA2ARXFP1MAPT
SCHEMBL6877538 0.84 MCHR1 (0.53) RAB9AMCHR1ADRA2ARXFP1MAPT

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
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP claimed
US-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 US disclosed
WO-2004087669-A1 NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO. LTD. (JP) 2004-10-14 WO disclosed
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 RAB9A 1648/4885MCHR1 2/4885ADRA2A 117/4885

“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.