SCHEMBL10705384

SCHEMBL10705384

O=C(C=C(Cl)Cl)c1cc(F)c(Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
APEX1 P27695 1/20 0.38
HPGD P15428 5/20 0.37
MAPT P10636 3/20 0.36
TSHR P16473 2/20 0.36
GPR27 Q9NS67 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
ALPL P05186 1/20 0.33
PIK3CA P42336 1/20 0.33
PLAU P00749 1/20 0.33
ELANE P08246 1/20 0.33
LMNA P02545 1/20 0.31

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
SCHEMBL10704260 0.79 CES2 (0.33) POLBAPEX1HPGDMAPTTSHR
SCHEMBL1180396 0.78 ALDH1A1 (0.45) POLBAPEX1HPGDMAPTTSHR
SCHEMBL9860353 0.78 POLB (0.41) POLBAPEX1HPGDMAPTTSHR
SCHEMBL9860356 0.78 POLB (0.41) POLBAPEX1HPGDMAPTTSHR
SCHEMBL29468147 0.76 GPR27 (0.37) POLBAPEX1HPGDMAPTTSHR
SCHEMBL5871710 0.75 KEAP1 (0.61) KEAP1NFE2L2
SCHEMBL8508742 0.74 POLB (0.43) POLBAPEX1HPGDMAPTTSHR
SCHEMBL221449 0.74 KEAP1 (0.53) POLBAPEX1HPGDMAPTTSHR
SCHEMBL23272826 0.72 CA12 (0.53) POLBAPEX1HPGDMAPTTSHR
SCHEMBL11045624 0.72 PLAU (0.42) POLBAPEX1HPGDMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0168732-B1 PROCESS FOR THE PREPARATION OF HALOGENATED AROYLACETIC ACID ESTERS BAYER AG (DE) 1988-07-27 EP disclosed
US-4611080-A Preparation of halogenated aroylacetic acid esters BAYER AKTIENGESELLSCHAFT (DE) 1986-09-09 US disclosed
EP-0168732-A2 Process for the preparation of halogenated aroylacetic acid esters BAYER AG (DE) 1986-01-22 EP disclosed