SCHEMBL2904787

SCHEMBL2904787

O=C(O)c1c(Cl)cc(C(=O)O)c2c(C(=O)O)c(Cl)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.46
ALDH1A1 P00352 4/20 0.44
TP53 P04637 1/20 0.44
KDM4E B2RXH2 4/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 3/20 0.40
CASP1 P29466 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
CSNK2A2 P19784 2/20 0.38
CSNK2B P67870 2/20 0.38

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
SCHEMBL29764017 0.82 ALDH1A1 (0.45) DPP4ALDH1A1TP53KDM4EHSD17B10
SCHEMBL24455 0.82 ALDH1A1 (0.45) DPP4ALDH1A1TP53KDM4EHSD17B10
SCHEMBL30254 0.81 CYP1A2 (0.44) DPP4ALDH1A1TP53KDM4EHSD17B10
SCHEMBL29764032 0.81 CYP1A2 (0.44) DPP4ALDH1A1TP53KDM4EHSD17B10
SCHEMBL1204591 0.79 CYP1A2 (0.56) DPP4ALDH1A1TP53KDM4EHSD17B10
SCHEMBL31401887 0.77 ALDH1A1 (0.41) DPP4ALDH1A1TP53KDM4EHSD17B10
SCHEMBL2897882 0.76 AKR1C4 (0.48) ALDH1A1TP53KDM4EHSD17B10MAPT
SCHEMBL9729751 0.74 ALDH1A1 (0.52) DPP4ALDH1A1TP53KDM4EHSD17B10
SCHEMBL6738393 0.73 ALDH1A1 (0.37) DPP4ALDH1A1TP53KDM4EHSD17B10
SCHEMBL11419997 0.71 ALDH1A1 (0.50) ALDH1A1TP53KDM4EHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100285292-A1 Aromatic Polyimide Film and Process for the Production Thereof TEIJIN LIMITED (JP) 2010-11-11 US disclosed
EP-1867675-A1 AROMATIC POLYIMIDE FILM AND METHOD FOR PRODUCING SAME Teiken Limited (JP) 2007-12-19 EP disclosed