SCHEMBL13793417

SCHEMBL13793417

Cc1ccc(F)c(C(=O)N[C@H]2CC[C@@H](Nc3nc(N(C)C)c4ccccc4n3)CC2)c1F

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 20/20 0.74
▸ ADRA2A P08913 16/20 0.74
▸ HRH1 P35367 3/20 0.71
▸ HTR2B P41595 3/20 0.71
▸ ADRA1A P35348 2/20 0.71
▸ NPY5R Q15761 2/20 0.71
▸ HTR1A P08908 1/20 0.71

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
SCHEMBL13797505 0.93 MCHR1 (0.81) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13794197 0.91 MCHR1 (0.69) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13794201 0.91 MCHR1 (0.69) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13797526 0.89 MCHR1 (0.81) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13794545 0.89 MCHR1 (0.61) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13793354 0.88 MCHR1 (0.76) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13793719 0.88 MCHR1 (0.84) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13793844 0.88 MCHR1 (0.73) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13793855 0.86 MCHR1 (0.75) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL13793841 0.85 MCHR1 (0.75) MCHR1ADRA2AHRH1HTR2BADRA1A

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-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
US-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
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