SCHEMBL4688480

SCHEMBL4688480

Cc1ccc(-c2ccoc2C(=O)NC2CCN(CCC3(CCCCCC(CO)C(=O)O)CCCCC3)CC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MTTP P55157 2/20 0.32
CHRM2 P08172 1/20 0.32
ADRA2A P08913 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD1 P21728 1/20 0.32
TBXA2R P21731 1/20 0.32
PTGS1 P23219 1/20 0.32
SLC6A2 P23975 1/20 0.32
ADRA1A P35348 1/20 0.32
OPRM1 P35372 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
KCNH2 Q12809 1/20 0.32
MTR Q99707 1/20 0.32
HTR4 Q13639 1/20 0.32
MAPK14 Q16539 1/20 0.32
MME P08473 1/20 0.32

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
SCHEMBL4688285 0.89 L3MBTL1 (0.36) MCHR1L3MBTL1HTR4CARM1PRMT6
SCHEMBL4693190 0.87 L3MBTL1 (0.39) MCHR1L3MBTL1ADRA1ADRD3MAPK14
SCHEMBL4690432 0.86 MCHR1 (0.39) MCHR1L3MBTL1MAPK14CARM1PRMT6
SCHEMBL4687554 0.85 L3MBTL1 (0.38) MCHR1L3MBTL1CARM1PRMT6ALDH1A1
SCHEMBL4691461 0.84 MCHR1 (0.38) MCHR1L3MBTL1ADRA1AMAPK14ALDH1A1
SCHEMBL4690036 0.84 MCHR1 (0.36) MCHR1L3MBTL1ALDH1A1CNR1
SCHEMBL1848745 0.84 ALDH1A1 (0.41) MCHR1L3MBTL1MTTPCHRM2ADRA2A
SCHEMBL5107097 0.84 L3MBTL1 (0.36) MCHR1L3MBTL1MTTPCHRM2ADRA2A
SCHEMBL4687466 0.82 L3MBTL1 (0.34) MCHR1L3MBTL1MTTPCHRM2ADRA2A
SCHEMBL4687344 0.82 MCHR1 (0.34) MCHR1L3MBTL1MAPK14ALDH1A1CNR1

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-1443046-B1 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME KYORIN SEIYAKU KK (JP) 2008-12-17 EP disclosed