SCHEMBL7930838

SCHEMBL7930838

Cc1ccc(C(=O)O)c(OS(=O)(=O)C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
USP2 O75604 1/20 0.43
HPGD P15428 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CSNK2A1 P68400 1/20 0.42
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CCR2 P41597 1/20 0.39
ACLY P53396 2/20 0.39
HSD11B1 P28845 1/20 0.39
METAP2 P50579 1/20 0.38
GRIK1 P39086 2/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
CYP2C9 P11712 1/20 0.37
PTGS2 P35354 1/20 0.37
MEN1 O00255 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
SCHEMBL25839257 0.89 HSD11B1 (0.46) ALDH1A1KDM4EUSP2HPGDCYP2C19
SCHEMBL7922665 0.88 CSNK2A1 (0.46) ALDH1A1KDM4EUSP2HPGDCYP2C19
SCHEMBL6643810 0.87 HSP90AA1 (0.43) ALDH1A1KDM4EHPGDHSD17B10CA1
SCHEMBL3303470 0.84 KDM4E (0.43) ALDH1A1KDM4EUSP2HPGDCYP2C19
SCHEMBL14872770 0.82 CA1 (0.47) ALDH1A1KDM4EHPGDHSD17B10CSNK2A1
SCHEMBL8154524 0.82 CSNK2A1 (0.46) ALDH1A1KDM4EHPGDHSD17B10CSNK2A1
SCHEMBL903987 0.82 KDM4E (0.45) ALDH1A1KDM4EHSD11B1MEN1KMT2A
SCHEMBL16737197 0.81 ALDH1A1 (0.61) ALDH1A1KDM4EUSP2HPGDCYP2C19
SCHEMBL6942043 0.80 CA1 (0.44) ALDH1A1KDM4EUSP2CA1CA2
SCHEMBL3493018 0.80 HSD11B1 (0.46) ALDH1A1CYP2C19CSNK2A1CA1CA2

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-0879814-B1 Triaromatic compounds, compositions containing them and uses thereof CT INTERNAT DE BR RECH S DERMA (FR) 2001-11-28 EP disclosed
EP-0879814-A1 Triaromatic compounds, compositions containing them and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-11-25 EP disclosed