SCHEMBL12325460

SCHEMBL12325460

CC(=O)c1c(Cl)ccc2c(C(C)=O)c(Cl)ccc12

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.43
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42
THRB P10828 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NOTUM Q6P988 1/20 0.37
HTT P42858 1/20 0.37
HPGD P15428 2/20 0.36
NPC1 O15118 2/20 0.36
PKM P14618 2/20 0.36
CYP3A4 P08684 1/20 0.36
ABCB11 O95342 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 2/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL3698047 0.83 MAPT (0.53) ALDH1A1HSD17B10KMT2AMEN1LMNA
SCHEMBL3767392 0.83 MAPT (0.53) ALDH1A1HSD17B10KMT2AMEN1LMNA
SCHEMBL3735504 0.80 DPP4 (0.43) DPP4ALDH1A1KDM4EHSD17B10THRB
SCHEMBL2424747 0.79 NCEH1 (0.51) ALDH1A1KDM4EHSD17B10KMT2AMEN1
SCHEMBL8074851 0.78 DPP4 (0.64) DPP4ALDH1A1KDM4EHSD17B10THRB
SCHEMBL9608358 0.78 DPP4 (0.41) DPP4ALDH1A1KDM4EHSD17B10THRB
SCHEMBL8330035 0.78 DPP4 (0.58) DPP4ALDH1A1KDM4EHSD17B10THRB
SCHEMBL12571909 0.78 P2RX7 (0.47) ALDH1A1KDM4EHSD17B10KMT2ALMNA
SCHEMBL976845 0.77 ALDH1A1 (0.61) ALDH1A1THRBNOTUMHPGDNPC1
SCHEMBL30978346 0.76 THRB (0.54) DPP4ALDH1A1KDM4EHSD17B10THRB

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-2011118845-A1 POLYESTER RESIN, AND OPTICAL MATERIALS, FILMS AND IMAGE DISPLAY DEVICES USING THE SAME FUJIFILM CORPORATION (JP) 2011-09-29 WO disclosed