SCHEMBL9568587

SCHEMBL9568587

C=CC(=O)Oc1ccccc1S(=O)(=O)Nc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
MAPT P10636 1/20 0.42
IDH1 O75874 2/20 0.42
PTK2B Q14289 1/20 0.42
MMP2 P08253 1/20 0.41
MMP13 P45452 1/20 0.41
IL1RN P18510 1/20 0.41
KEAP1 Q14145 1/20 0.41
ERAP1 Q9NZ08 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
ACLY P53396 1/20 0.40
FABP4 P15090 1/20 0.40
PGR P06401 1/20 0.40
CCR8 P51685 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL9568803 0.82 THRB (0.45) THRATHRBMAPTTSHRACLY
SCHEMBL3253807 0.80 CA12 (0.46) MAPTIDH1PTK2BACLYFABP4
SCHEMBL9568582 0.79 THRB (0.48) THRATHRBALDH1A1ACLY
SCHEMBL9568742 0.79 CASP1 (0.43) THRATHRB
SCHEMBL29602140 0.79 THRB (0.46) THRATHRBMAPTTSHRALDH1A1
SCHEMBL964747 0.79 THRB (0.46) THRATHRBMAPT
SCHEMBL593505 0.79 THRB (0.46) THRATHRBMAPTTSHRALDH1A1
SCHEMBL9568736 0.78 KMT2A (0.56) MAPTIL1RNKEAP1ERAP1ALDH1A1
SCHEMBL9568753 0.77 CA12 (0.53) THRATHRBALDH1A1POLBACLY
SCHEMBL9568790 0.75 PGR (0.60) MAPTIL1RNKEAP1ERAP1ALDH1A1

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
EP-0544264-A1 Light-sensitive composition FUJI PHOTO FILM CO., LTD. (JP) 1993-06-02 EP disclosed