SCHEMBL9275403

SCHEMBL9275403

CCCC(=O)c1cc(F)c(F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
APEX1 P27695 1/20 0.49
HPGD P15428 6/20 0.47
TSHR P16473 3/20 0.47
RECQL P46063 2/20 0.47
ALDH1A1 P00352 2/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
HTT P42858 1/20 0.46
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41

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
SCHEMBL9227041 0.85 POLB (0.51) POLBAPEX1HPGDTSHRRECQL
SCHEMBL31344360 0.82 HPGD (0.52) HPGDTSHRRECQLALDH1A1ALOX15
SCHEMBL2298671 0.82 HPGD (0.52) HPGDTSHRRECQLALDH1A1ALOX15
SCHEMBL8967743 0.79 HPGD (0.46) POLBHPGDTSHRRECQLALDH1A1
SCHEMBL9516561 0.79 ALDH1A1 (0.55) POLBAPEX1HPGDTSHRALDH1A1
SCHEMBL9224306 0.78 CYP1A2 (0.51) POLBAPEX1HPGDTSHRRECQL
SCHEMBL3921010 0.77 POLB (0.47) POLBAPEX1HPGDTSHRCYP1A2
Formic Acid SCHEMBL5566788 0.76 HPGD (0.46) HPGDTSHRRECQLALDH1A1ALOX15
SCHEMBL18506307 0.76 ALDH1A1 (0.46) HPGDTSHRRECQLALDH1A1ALOX15
Ethylene SCHEMBL10650663 0.76 HPGD (0.44) POLBHPGDTSHRRECQLALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5068449-A FLUORINATED BENZOYL COMPOUNDS ASAHI GLASS COMPANY, LTD. (JP) 1991-11-26 US claimed
EP-0303291-B1 Fluorinated benzoyl compounds ASAHI GLASS CO LTD (JP) 1995-04-26 EP disclosed
US-5093515-A Intermediate for quinolone carboxylic acid bactericide ASAHI GLASS COMPANY LTD. (JP) 1992-03-03 US disclosed
US-5068449-A FLUORINATED BENZOYL COMPOUNDS ASAHI GLASS COMPANY, LTD. (JP) 1991-11-26 US disclosed
US-4994610-A Process for preparing fluorinated benzoyl compounds ASAHI GLASS COMPANY, LTD. (JP) 1991-02-19 US disclosed
EP-0303291-A2 Fluorinated benzoyl compounds ASAHI GLASS COMPANY LTD. (JP) 1989-02-15 EP disclosed