SCHEMBL8923591

SCHEMBL8923591

Cc1ccc(S(=O)(=O)OCCO)cc1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 7/20 0.45
HTT P42858 2/20 0.45
PKM P14618 2/20 0.42
GAA P10253 1/20 0.41
YAP1 P46937 1/20 0.40
TEAD4 Q15561 1/20 0.40
CTSG P08311 2/20 0.39
CMA1 P23946 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL4687253 0.90 ALDH1A1 (0.46) LMNATDP1ALDH1A1HTTPKM
SCHEMBL8923582 0.84 LMNA (0.48) LMNATDP1ALDH1A1HTTPKM
SCHEMBL4687415 0.83 LMNA (0.47) LMNATDP1ALDH1A1HTTPKM
SCHEMBL4684141 0.82 ALDH1A1 (0.37) LMNAALDH1A1HTTGAA
SCHEMBL5663959 0.81 CA2 (0.50) LMNATDP1ALDH1A1HTTPKM
SCHEMBL4687250 0.81 LMNA (0.46) LMNATDP1ALDH1A1HTTPKM
SCHEMBL1258986 0.80 STAT3 (0.47) ALDH1A1GAAKMT2AMEN1
SCHEMBL11880300 0.79 RECQL (0.46) LMNATDP1ALDH1A1HTTPKM
SCHEMBL11880309 0.79 RECQL (0.46) LMNATDP1ALDH1A1HTTPKM
SCHEMBL5501025 0.79 RECQL (0.46) LMNATDP1ALDH1A1HTTPKM

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
US-5639770-A SUPEROXIDE INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-06-17 US disclosed
EP-0600092-A1 THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP disclosed