SCHEMBL14252243

SCHEMBL14252243

O=C(O)c1ccc(-c2cccc(F)c2)cc1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DCLRE1B Q9H816 1/20 0.67
ESR2 Q92731 1/20 0.53
DHODH Q02127 1/20 0.52
ACMSD Q8TDX5 3/20 0.51
HNF4A P41235 2/20 0.50
MCL1 Q07820 2/20 0.50
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
DHFR P00374 1/20 0.50
HCAR2 Q8TDS4 1/20 0.49
TRPM2 O94759 1/20 0.49
BCL2L1 Q07817 1/20 0.49
BAD Q92934 1/20 0.49
TAAR1 Q96RJ0 2/20 0.48
KMO O15229 2/20 0.47
AKR1C2 P52895 1/20 0.46
AKR1C1 Q04828 1/20 0.46

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
SCHEMBL29363677 0.87 DCLRE1B (0.60) DCLRE1BESR2DHODHACMSDHNF4A
SCHEMBL2160051 0.87 DCLRE1B (0.60) DCLRE1BESR2DHODHACMSDHNF4A
SCHEMBL1099041 0.86 ACMSD (0.66) DCLRE1BACMSDHNF4AMCL1DHFR
SCHEMBL30605782 0.86 ACMSD (0.66) DCLRE1BACMSDHNF4AMCL1DHFR
SCHEMBL29395437 0.86 ACMSD (0.66) DCLRE1BACMSDHNF4AMCL1DHFR
SCHEMBL8999909 0.86 ACMSD (0.66) DCLRE1BACMSDHNF4AMCL1DHFR
SCHEMBL27630318 0.86 ACMSD (0.71) DCLRE1BESR2DHODHACMSDHNF4A
SCHEMBL3685447 0.86 ACMSD (0.72) DCLRE1BESR2ACMSDHNF4AMCL1
SCHEMBL10024256 0.84 DCLRE1B (0.57) DCLRE1BESR2DHODHACMSDHNF4A
SCHEMBL14089870 0.84 DCLRE1B (0.61) DCLRE1BESR2DHODHACMSDHNF4A

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
US-7339071-B2 Aryl ethynyl phthalic acid derivative and method for producing the same FUJIFILM CORPORATION (JP) 2008-03-04 US disclosed