SCHEMBL9568700

SCHEMBL9568700

C=CC(=O)Oc1cccc(NS(C)(=O)=O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
ALDH1A1 P00352 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
DRD3 P35462 1/20 0.45
KEAP1 Q14145 1/20 0.43
PGR P06401 1/20 0.43
PIP4K2A P48426 1/20 0.43
PIP4K2B P78356 1/20 0.43
EGFR P00533 1/20 0.43
DHX9 Q08211 1/20 0.42
HPGD P15428 1/20 0.41
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
F2 P00734 1/20 0.41
F10 P00742 1/20 0.41
MAP2K1 Q02750 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL9568699 0.86 EGFR (0.43) ALDH1A1SMN1; SMN2EGFRHPGDMAP2K1
SCHEMBL9568805 0.82 LMNA (0.52) POLBALDH1A1SMN1; SMN2KEAP1PGR
SCHEMBL9326040 0.81 PGR (0.51) ALDH1A1SMN1; SMN2KEAP1PGRHPGD
SCHEMBL9568712 0.81 TCF4 (0.58) ALDH1A1SMN1; SMN2HPGDF2MEN1
SCHEMBL3248027 0.81 ALDH1A1 (0.54) POLBALDH1A1SMN1; SMN2DRD2DRD4
SCHEMBL9770316 0.80 EGFR (0.47) POLBALDH1A1SMN1; SMN2EGFRMEN1
SCHEMBL28707248 0.79 POLB (0.52) POLBALDH1A1SMN1; SMN2DRD2DRD4
SCHEMBL4204011 0.77 PGR (0.62) POLBALDH1A1SMN1; SMN2DRD2DRD4
SCHEMBL27403596 0.77 MEP1B (0.41) KEAP1PGRKDR
SCHEMBL10946691 0.77 TGM2 (0.59) ALDH1A1EGFRMEN1KMT2AFAAH

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