SCHEMBL6875415

SCHEMBL6875415

Cc1cc(NC(=O)NC[C@H]2CC[C@@H](Nc3cc(N(C)C)c4ccccc4n3)CC2)c(C(F)(F)F)o1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 12/20 0.42
▸ ADRA2A P08913 8/20 0.42
▸ NPY5R Q15761 7/20 0.42
▸ ADRA1A P35348 3/20 0.37
▸ HTR2B P41595 3/20 0.37
▸ HTR1A P08908 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HRH1 P35367 2/20 0.36
▸ ACP1 P24666 1/20 0.36
▸ ACACB O00763 1/20 0.35
▸ ACACA Q13085 1/20 0.35
▸ AR P10275 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ CCR8 P51685 1/20 0.35

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
SCHEMBL6875424 1.00 MCHR1 (0.42) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6879274 0.90 MCHR1 (0.42) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6879265 0.90 MCHR1 (0.42) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6867920 0.89 ACP1 (0.44) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6867914 0.89 ACP1 (0.44) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6874786 0.88 MCHR1 (0.49) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6874781 0.88 MCHR1 (0.49) MCHR1ADRA2ANPY5RADRA1AHTR2B
SCHEMBL6867311 0.86 KDM4E (0.43) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6867313 0.86 KDM4E (0.43) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL4193669 0.86 MCHR1 (0.57) MCHR1ADRA2ANPY5RADRA1AHTR2B

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 1 patent. 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 disclosed
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