SCHEMBL6879265

SCHEMBL6879265

Cc1cc(NC(=O)N[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 12)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 12/20 0.42
▸ ADRA2A P08913 10/20 0.42
▸ HTR1A P08908 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ HRH1 P35367 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ LMNA P02545 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ EPHX1 P07099 1/20 0.38

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
SCHEMBL6879274 1.00 MCHR1 (0.42) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL6875415 0.90 MCHR1 (0.42) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL6875424 0.90 MCHR1 (0.42) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL27653069 0.87 MCHR1 (0.47) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL6873592 0.87 MCHR1 (0.47) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL6876600 0.86 ACP1 (0.47) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL6876607 0.86 ACP1 (0.47) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL4538091 0.85 MCHR1 (0.61) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL4538087 0.85 MCHR1 (0.61) MCHR1ADRA2AHTR1AADRA1AHRH1
SCHEMBL6880627 0.84 RXFP1 (0.49) MCHR1ADRA2AHTR1AADRA1AHRH1

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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