SCHEMBL8599776

SCHEMBL8599776

CNC(=O)c1ccc(S)c(C(=O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 3/20 0.46
▸ HDAC6 Q9UBN7 2/20 0.46
▸ HDAC2 Q92769 1/20 0.46
▸ NEU3 Q9UQ49 1/20 0.45
▸ PLAU P00749 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MAPT P10636 1/20 0.42
▸ PLK1 P53350 4/20 0.42
▸ MRGPRX4 Q96LA9 1/20 0.41
▸ CREBBP Q92793 1/20 0.41
▸ CDC25A P30304 1/20 0.41
▸ CDC25B P30305 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ THRB P10828 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
SCHEMBL20869767 0.83 CDC25A (0.58) HDAC8HDAC6HDAC2NEU3PLAU
SCHEMBL5227394 0.82 MAPT (0.54) HDAC8KDM4ETSHRMAPTCDC25A
SCHEMBL15315480 0.81 CDC25A (0.52) HDAC8HDAC6HDAC2NEU3PLAU
SCHEMBL12132581 0.80 TDP1 (0.49) HDAC8HDAC6HDAC2NEU3PLAU
SCHEMBL3183610 0.79 AKR1C3 (0.53) HDAC8MAPT
SCHEMBL28206667 0.79 KDM4E (0.50) HDAC8KDM4EHPGDTSHRHTT
SCHEMBL27188289 0.79 ALDH1A1 (0.53) HDAC8HDAC6HDAC2PLAUKDM4E
SCHEMBL15386806 0.78 NEU3 (0.59) HDAC8HDAC6HDAC2NEU3KDM4E
SCHEMBL6516443 0.78 AKR1C3 (0.51) HDAC8MAPT
SCHEMBL6516435 0.78 AKR1C3 (0.51) HDAC8MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0598241-B1 Lithographic printing material FUJI PHOTO FILM CO LTD (JP) 1998-02-04 — — EP disclosed
US-5387483-A Developer containing silver halide solvent and hydroquinone; has pH up to 11.8 FUJI PHOTO FILM CO., LTD. (JP) 1995-02-07 — — US disclosed
EP-0610936-A2 Lithographic printing material FUJI PHOTO FILM CO., LTD. (JP) 1994-08-17 — — EP disclosed
EP-0601600-A2 Processing of lithographic printing material and developer used therein FUJI PHOTO FILM CO., LTD. (JP) 1994-06-15 — — EP disclosed
EP-0598241-A1 Lithographic printing material FUJI PHOTO FILM CO., LTD. (JP) 1994-05-25 — — EP disclosed
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