SCHEMBL8790660

SCHEMBL8790660

CC(Cc1ccc2c(c1)cc(C(=O)O)n2Cc1ccc(NCS(=O)(=O)C(F)(F)F)cc1)NCC(O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 10/20 0.45
CCR2 P41597 1/20 0.42
ADRB1 P08588 10/20 0.40
ADRB3 P13945 10/20 0.40
PPARG P37231 6/20 0.39
SERPINE1 P05121 1/20 0.39

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
SCHEMBL8792020 0.94 ADRB2 (0.44) ADRB2CCR2ADRB1ADRB3PPARG
SCHEMBL8791273 0.94 ADRB2 (0.46) ADRB2CCR2ADRB1ADRB3PPARG
SCHEMBL8790482 0.93 ADRB2 (0.46) ADRB2CCR2ADRB1ADRB3SERPINE1
SCHEMBL8792546 0.92 ADRB2 (0.45) ADRB2CCR2ADRB1ADRB3PPARG
SCHEMBL8793375 0.92 ADRB3 (0.49) ADRB2ADRB1ADRB3
SCHEMBL8791814 0.92 ADRB2 (0.45) ADRB2CCR2ADRB1ADRB3SERPINE1
SCHEMBL8791915 0.90 ADRB2 (0.46) ADRB2CCR2ADRB1ADRB3PPARG
SCHEMBL8793420 0.89 ADRB2 (0.46) ADRB2CCR2ADRB1ADRB3PPARG
SCHEMBL8791505 0.88 ADRB2 (0.45) ADRB2CCR2ADRB1ADRB3PPARG
SCHEMBL8790987 0.88 ADRB2 (0.46) ADRB2CCR2ADRB1ADRB3SERPINE1

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