SCHEMBL26136102

SCHEMBL26136102

O=C(O)CCc1cc(-c2ccc(C(F)(F)F)cc2)[nH]c1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.45
HDAC11 Q96DB2 2/20 0.43
APOL1 O14791 2/20 0.43
FFAR4 Q5NUL3 1/20 0.43
PPARG P37231 3/20 0.42
PPARA Q07869 3/20 0.42
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42
APH1A Q96BI3 1/20 0.42
PSENEN Q9NZ42 1/20 0.42
TNKS O95271 1/20 0.41
PPARD Q03181 1/20 0.41
GPR35 Q9HC97 1/20 0.40
S1PR1 P21453 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40

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
SCHEMBL26129646 0.86 GCGR (0.46) FFAR1PPARG
SCHEMBL30613272 0.79 APOL1 (0.64) FFAR1APOL1FFAR4PPARGPPARA
SCHEMBL4596931 0.75 FFAR4 (0.49) FFAR1FFAR4PPARGPPARAPSEN1
SCHEMBL4007916 0.75 FFAR1 (0.58) FFAR1FFAR4PTGDR2
SCHEMBL3333875 0.74 NR1H4 (0.46) FFAR1FFAR4PSEN1PSEN2APH1B
SCHEMBL26135029 0.74 APOL1 (0.80) APOL1
SCHEMBL26583923 0.73 CDC7 (0.51) APOL1
SCHEMBL7242930 0.73 PPARG (0.50) PPARG
SCHEMBL31750436 0.72 FFAR1 (0.54) FFAR1FFAR4PTGDR2
Hydrochloric Acid SCHEMBL34474962 0.71 FFAR1 (0.53) FFAR1FFAR4PTGDR2

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
WO-2023194895-A1 PYRROL DERIVATIVES AS INHIBITORS OF APOLIPOPROTEIN L-1 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-12 WO disclosed