SCHEMBL7560832

SCHEMBL7560832

CC(C(=O)Nc1ccccc1)c1cccc(-c2ccc(CC3SC(=O)NC3=O)cc2)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.52
PSEN1 P49768 7/20 0.51
PSEN2 P49810 7/20 0.51
APH1B Q8WW43 7/20 0.51
NCSTN Q92542 7/20 0.51
APH1A Q96BI3 7/20 0.51
PSENEN Q9NZ42 7/20 0.51
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PPARG P37231 5/20 0.46

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
SCHEMBL7087432 0.87 FFAR1 (0.48) FFAR1MAPTSMN1; SMN2PPARG
SCHEMBL7559661 0.84 FFAR1 (0.51) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL6480621 0.84 FFAR1 (0.54) FFAR1MAPTPPARG
SCHEMBL7563417 0.84 FFAR1 (0.56) FFAR1PPARG
SCHEMBL6184770 0.83 FFAR1 (0.59) FFAR1MAPTPPARG
SCHEMBL6187981 0.81 FFAR1 (0.59) FFAR1MAPTPPARG
SCHEMBL6183947 0.80 FFAR1 (0.58) FFAR1MAPTPPARG
SCHEMBL6187556 0.79 FFAR1 (0.60) FFAR1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL6182666 0.79 FFAR1 (0.52) FFAR1MAPTPPARG
SCHEMBL6184201 0.78 FFAR1 (0.57) FFAR1MAPTPPARG

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-2002012210-A9 BIPHENYL DERIVATIVES AND THEIR USE AS PPAR-GAMMA RECEPTOR ACTIVATORS GALDERMA RES & DEV (FR) 2002-04-18 WO disclosed