SCHEMBL7130425

SCHEMBL7130425

CCCCCCCCCCCCCCCCNS(=O)(=O)c1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.60
HTT P42858 4/20 0.60
LMNA P02545 3/20 0.60
MAPK1 P28482 1/20 0.60
PKM P14618 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
SMN1; SMN2 Q16637 4/20 0.58
KDM4E B2RXH2 1/20 0.58
EPHX2 P34913 1/20 0.56
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
TSHR P16473 2/20 0.53
RECQL P46063 1/20 0.53
NPY1R P25929 1/20 0.52
NPY2R P49146 1/20 0.52
TBXA2R P21731 1/20 0.51

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
SCHEMBL9293546 0.88 ALDH1A1 (0.59) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL10906482 0.88 ALDH1A1 (0.59) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL9154917 0.88 ALDH1A1 (0.59) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL223156 0.86 ALDH1A1 (0.72) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL8355315 0.86 ALDH1A1 (0.72) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL1465715 0.86 ALDH1A1 (0.57) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL633648 0.86 ALDH1A1 (0.72) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL9293542 0.86 LMNA (0.60) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL634183 0.86 ALDH1A1 (0.72) ALDH1A1HTTLMNAMAPK1PKM
SCHEMBL7103280 0.86 ALDH1A1 (0.72) ALDH1A1HTTLMNAMAPK1PKM

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-1051655-A4 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY ISTA PHARMACEUTICALS INC (US) 2003-03-19 EP disclosed
US-20010016731-A1 Methods and apparatus for accelerated orthokeratology DEVORE DALE (US) 2001-08-23 US disclosed
US-6161544-A Methods for accelerated orthokeratology KERATOFORM, INC. (US) 2000-12-19 US disclosed
EP-1051655-A1 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY Ista Pharmaceuticals, Inc. (US) 2000-11-15 EP disclosed
WO-1999039238-A1 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY KERATOFORM, INC. (US) 1999-08-05 WO disclosed