SCHEMBL8464923

SCHEMBL8464923

O=Ic1ccc(-c2ccccc2)cc1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.41
HTR6 P50406 1/20 0.40
ALOX5 P09917 1/20 0.37
MEN1 O00255 3/20 0.37
MAPT P10636 3/20 0.37
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
THRB P10828 2/20 0.37
BLM P54132 2/20 0.37
LMNA P02545 2/20 0.37
HTT P42858 2/20 0.37
APAF1 O14727 1/20 0.37
NPC1 O15118 1/20 0.37
XBP1 P17861 1/20 0.37
PTBP1 P26599 1/20 0.37
RAB9A P51151 1/20 0.37
GALK1 P51570 1/20 0.37
SMAD3 P84022 1/20 0.37
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL8367501 0.77 ALOX5 (0.55) PTPN1ALOX5MEN1MAPTKMT2A
SCHEMBL8464926 0.76 LMNA (0.47) THRBLMNAL3MBTL1CA12CA2
SCHEMBL8463731 0.75 MYC (0.41) MAPTSMN1; SMN2LMNAL3MBTL1TSHR
SCHEMBL4843096 0.75 MAOB (0.48) PTPN1HTR6ALOX5MEN1MAPT
SCHEMBL4190433 0.75 ACLY (0.50) PTPN1ACLY
SCHEMBL5973210 0.75 IKBKB (0.51) PTPN1HTR6MEN1MAPTKMT2A
SCHEMBL8464469 0.74 ALDH1A1 (0.41) SMN1; SMN2LMNATSHRCA12CA2
SCHEMBL16583502 0.74 SMN1; SMN2 (0.50) PTPN1HTR6ALOX5MEN1MAPT
SCHEMBL8462919 0.73 PTPN1 (0.39) PTPN1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL8365978 0.73 ALOX5 (0.55) PTPN1HTR6ALOX5MEN1MAPT

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
EP-0745326-B1 Stabilization of aqueous 3-isothiazolone solutions ROHM & HAAS (US) 1999-09-22 EP disclosed
US-5594017-A WITH AN IODOSYL OR IODYL COMPOUND ROHM AND HAAS COMPANY (US) 1997-01-14 US disclosed
EP-0745326-A1 Stabilization of aqueous 3-isothiazolone solutions ROHM AND HAAS COMPANY (US) 1996-12-04 EP disclosed