SCHEMBL8723192

SCHEMBL8723192

COC(=O)Cc1ccccc1COc1cc(C(F)(F)F)cc(C)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLQ O75417 1/20 0.46
NR1H4 Q96RI1 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GAA P10253 2/20 0.40
OPRL1 P41146 1/20 0.40
PPARD Q03181 2/20 0.39
PPARA Q07869 2/20 0.39
PPARG P37231 1/20 0.39
NR2E1 Q9Y466 3/20 0.38
RORA P35398 1/20 0.38
HIF1A Q16665 1/20 0.38
LMNA P02545 1/20 0.38
GRM5 P41594 1/20 0.37
MRGPRX4 Q96LA9 2/20 0.36
TACR1 P25103 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL8723181 0.80 HIF1A (0.45) POLQNR1H4GAAOPRL1HIF1A
SCHEMBL8726648 0.79 HIF1A (0.44) POLQNR1H4GAAOPRL1HIF1A
SCHEMBL8726645 0.79 HIF1A (0.44) POLQNR1H4GAAOPRL1HIF1A
SCHEMBL8723182 0.78 HIF1A (0.44) POLQNR1H4GAAOPRL1HIF1A
SCHEMBL8723178 0.78 HIF1A (0.44) POLQNR1H4GAAOPRL1HIF1A
SCHEMBL31287376 0.78 SYK (0.43) ALDH1A1MAPTHPGDTDP1GAA
SCHEMBL31287377 0.78 SYK (0.43) ALDH1A1MAPTHPGDTDP1GAA
SCHEMBL7777172 0.78 SYK (0.43) ALDH1A1MAPTHPGDTDP1GAA
SCHEMBL28334166 0.76 HPGD (0.40) ALDH1A1MAPTHPGDTDP1LMNA
SCHEMBL8723195 0.76 ALDH1A1 (0.39) POLQALDH1A1MAPTHPGDTDP1

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
EP-0840726-A1 PROCESS FOR THE PREPARATION OF 2-(6-SUBSTITUTED PYRID-2-YLOXYMETHYL)PHENYLACETATE ZENECA LIMITED (GB) 1998-05-13 EP disclosed
WO-1997001538-A1 PROCESS FOR THE PREPARATION OF 2-(6-SUBSTITUTED PYRID-2-YLOXYMETHYL)PHENYLACETATE ZENECA LIMITED (GB) 1997-01-16 WO disclosed