SCHEMBL8511604

SCHEMBL8511604

O=S(=O)(Nc1nccs1)c1cnc(O)nc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
LMNA P02545 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
KDM4E B2RXH2 1/20 0.59
CYP2C9 P11712 1/20 0.59
EDNRA P25101 1/20 0.59
SLC6A4 P31645 1/20 0.59
ADRA1A P35348 1/20 0.59
PRMT6 Q96LA8 1/20 0.59
KMT2A Q03164 4/20 0.58
CYP1A2 P05177 1/20 0.57
MEN1 O00255 3/20 0.55
PKM P14618 5/20 0.52
PPIA P62937 2/20 0.50
ATM Q13315 1/20 0.50
TSHR P16473 1/20 0.49
PHLPP2 Q6ZVD8 1/20 0.48

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
SCHEMBL1650814 0.81 ALDH1A1 (0.72) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
SCHEMBL12383540 0.77 ALDH1A1 (0.62) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
SCHEMBL713015 0.77 LMNA (0.71) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
SCHEMBL712101 0.77 ALDH1A1 (0.71) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
SCHEMBL326633 0.77 ALDH1A1 (0.71) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
Hydrochloric Acid SCHEMBL27575105 0.75 ALDH1A1 (0.69) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
SCHEMBL3066836 0.75 LMNA (0.79) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
SCHEMBL3476554 0.75 ALDH1A1 (0.60) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
SCHEMBL3002532 0.74 ALDH1A1 (0.68) ALDH1A1LMNASMN1; SMN2TDP1KDM4E
SCHEMBL8388562 0.74 PPIA (0.76) ALDH1A1LMNASMN1; SMN2TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958910-A Use of N-(4-aryl-thiazol-2-yl)-sulfonamides HOFFMANN-LA ROCHE INC. (US) 1999-09-28 US disclosed
US-5877193-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS HOFFMANN-LA ROCHE INC. (US) 1999-03-02 US disclosed
EP-0819681-A2 N-(4-Aryl-thiazol-2-yl)-sulfonamides and their use F. HOFFMANN-LA ROCHE AG (CH) 1998-01-21 EP disclosed