SCHEMBL8778749

SCHEMBL8778749

CC(O)S(=O)(=O)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.50
HPGD P15428 2/20 0.50
ALDH1A1 P00352 2/20 0.50
FPR1 P21462 1/20 0.50
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP13 P45452 1/20 0.48
PRSS1 P07477 2/20 0.48
PRSS2 P07478 2/20 0.48
PRSS3 P35030 2/20 0.48
FAAH O00519 1/20 0.48
ELANE P08246 1/20 0.48
PRTN3 P24158 1/20 0.48
CA5A P35218 1/20 0.48
CA9 Q16790 1/20 0.48
TSHR P16473 3/20 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
SCHEMBL10452515 0.89 KMT2A (0.40) HSD17B10HPGDALDH1A1FPR1TSHR
SCHEMBL10452951 0.86 ALDH1A1 (0.38) HSD17B10HPGDALDH1A1FPR1TSHR
SCHEMBL11209277 0.84 POLB (0.46) HSD17B10HPGDALDH1A1FPR1KMT2A
SCHEMBL11209267 0.84 POLB (0.46) HSD17B10HPGDALDH1A1FPR1KMT2A
SCHEMBL31171043 0.84 HSD17B10 (0.47) HSD17B10HPGDALDH1A1FPR1CA1
SCHEMBL3252117 0.83 CA1 (0.52) HSD17B10HPGDALDH1A1FPR1CA1
SCHEMBL8997405 0.82 ALDH1A1 (0.52) HSD17B10ALDH1A1CA1CA2CA5A
SCHEMBL6558824 0.82 HSD17B10 (0.49) HSD17B10HPGDALDH1A1FPR1CA1
SCHEMBL9574414 0.81 HPGD (0.37) HSD17B10HPGDALDH1A1FPR1KMT2A
SCHEMBL8778816 0.80 CA1 (0.46) HSD17B10HPGDALDH1A1FPR1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5300143-A Water soluble dye, sulfone, and amide or cyclic amine XEROX CORPORATION (US) 1994-04-05 US claimed
EP-0602914-B1 Ink compositions for ink jet printing XEROX CORP (US) 1997-11-12 EP disclosed
EP-0602914-A1 Ink compositions for ink jet printing XEROX CORPORATION (US) 1994-06-22 EP disclosed
US-5300143-A Water soluble dye, sulfone, and amide or cyclic amine XEROX CORPORATION (US) 1994-04-05 US disclosed