SCHEMBL8792020

SCHEMBL8792020

CC(Cc1ccc2c(c1)cc(C(=O)O)n2Cc1cccc(NCS(=O)(=O)C(F)(F)F)c1)NCC(O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 3/20 0.44
CCR2 P41597 1/20 0.41
PPARG P37231 10/20 0.41
ADRB3 P13945 3/20 0.38
SERPINE1 P05121 1/20 0.38
ADRB1 P08588 3/20 0.37
NR1I2 O75469 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
CHRM3 P20309 1/20 0.37
SLC6A2 P23975 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
SLC6A4 P31645 1/20 0.37
ADRA1A P35348 1/20 0.37
HRH1 P35367 1/20 0.37
OPRM1 P35372 1/20 0.37

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
SCHEMBL8790660 0.94 ADRB2 (0.45) ADRB2CCR2PPARGADRB3SERPINE1
SCHEMBL8791505 0.94 ADRB2 (0.45) ADRB2CCR2PPARGADRB3SERPINE1
SCHEMBL8790987 0.94 ADRB2 (0.46) ADRB2CCR2ADRB3SERPINE1ADRB1
SCHEMBL8793357 0.93 ADRB2 (0.44) ADRB2CCR2PPARGADRB3SERPINE1
SCHEMBL8791862 0.92 ADRB3 (0.48) ADRB2ADRB3ADRB1ADRA2AADRA2B
SCHEMBL8791149 0.92 ADRB2 (0.44) ADRB2CCR2ADRB3SERPINE1ADRB1
SCHEMBL8793387 0.91 ADRB2 (0.46) ADRB2CCR2PPARGADRB3SERPINE1
SCHEMBL8791797 0.90 PPARG (0.46) ADRB2CCR2PPARGADRB3SERPINE1
SCHEMBL8791273 0.88 ADRB2 (0.46) ADRB2CCR2PPARGADRB3SERPINE1
SCHEMBL8790482 0.87 ADRB2 (0.46) ADRB2CCR2ADRB3SERPINE1ADRB1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0703911-B1 SECONDARY AMINES AS ANTIDIABETIC AND ANTIOBESITY AGENTS PFIZER (US) 1997-07-02 EP disclosed
EP-0703911-A1 SECONDARY AMINES AS ANTIDIABETIC AND ANTIOBESITY AGENTS PFIZER (US) 1996-04-03 EP disclosed
WO-1994029290-A1 SECONDARY AMINES AS ANTIDIABETIC AND ANTIOBESITY AGENTS PFIZER INC. (US) 1994-12-22 WO disclosed