SCHEMBL6519743

SCHEMBL6519743

CSc1nc2ccccc2n1S(=O)(=O)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
TSHR P16473 2/20 0.49
MAPK1 P28482 2/20 0.49
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.49
PKM P14618 1/20 0.49
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
ATM Q13315 1/20 0.45
POLB P06746 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HTT P42858 1/20 0.43
ALDH3A1 P30838 1/20 0.43

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
SCHEMBL5250721 0.77 ALDH3A1 (0.69) L3MBTL1TSHRALDH1A1LMNASMN1; SMN2
SCHEMBL990493 0.75 NOD1 (0.45) TSHRALDH1A1LMNASMN1; SMN2POLB
SCHEMBL28063595 0.75 SMN1; SMN2 (0.52) TSHRALDH1A1LMNASMN1; SMN2POLB
SCHEMBL11327144 0.73 NOD1 (0.44) TSHRALDH1A1LMNASMN1; SMN2POLB
SCHEMBL9320052 0.73 NOD1 (0.44) TSHRALDH1A1LMNASMN1; SMN2POLB
SCHEMBL573404 0.72 KDM4E (0.53) TSHRALDH1A1LMNASMN1; SMN2POLB
SCHEMBL4160892 0.72 ATM (0.75) L3MBTL1TSHRMAPK1MAPTALDH1A1
SCHEMBL9394279 0.71 NOD1 (0.42) TSHRALDH1A1LMNASMN1; SMN2POLB
SCHEMBL8362182 0.71 L3MBTL1 (0.68) L3MBTL1TSHRMAPK1MAPTALDH1A1
SCHEMBL8362187 0.70 NPC1 (0.58) L3MBTL1TSHRMAPK1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1051655-B1 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY ISTA PHARMACEUTICALS INC (US) 2005-09-28 EP disclosed
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
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP 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-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
WO-1999039238-A1 METHODS AND APPARATUS FOR ACCELERATED ORTHOKERATOLOGY KERATOFORM, INC. (US) 1999-08-05 WO disclosed