SCHEMBL7162191

SCHEMBL7162191

[CH2]NS(=O)(=O)c1ccccc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
TDP1 Q9NUW8 2/20 0.49
TP53 P04637 1/20 0.49
EDNRA P25101 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC1A3 P43003 1/20 0.46
SLC1A2 P43004 1/20 0.46
SLC1A1 P43005 1/20 0.46
PKM P14618 2/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 2/20 0.45
KAT6A Q92794 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
EDNRB P24530 1/20 0.45
SLC40A1 Q9NP59 1/20 0.44
SLC22A12 Q96S37 2/20 0.42
CA1 P00915 1/20 0.42

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
SCHEMBL6927887 0.82 EDNRA (0.54) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL634340 0.80 LMNA (0.57) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL30338563 0.80 LMNA (0.57) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL460107 0.78 ALDH1A1 (0.49) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL4636106 0.78 CA1 (0.55) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL10530500 0.78 ALDH1A1 (0.49) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL297109 0.78 ALDH1A1 (0.51) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL31268095 0.78 SLC1A3 (0.50) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL7630639 0.78 EDNRA (0.49) ALDH1A1TDP1TP53EDNRARXFP1
SCHEMBL420849 0.78 SLC1A3 (0.50) ALDH1A1TDP1TP53EDNRARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6428582-B1 Dye mixtures, 1:2 cobalt complex formazan dyes and their use CIBA SPECIALTY CHEMICALS CORPORATION 2002-08-06 US claimed
US-6551364-B2 Diazotizing the coresponding amine compound; metallization CIBA SPECIALTY CHEMICALS CORPORATION 2003-04-22 US disclosed
US-6428582-B1 Dye mixtures, 1:2 cobalt complex formazan dyes and their use CIBA SPECIALTY CHEMICALS CORPORATION 2002-08-06 US disclosed
US-20010014733-A1 Dye mixtures, 1:2 cobalt complex formazan dyes and their use HUNTSMAN INTERNATIONAL LLC 2001-08-16 US disclosed
EP-0625550-B1 Dye mixtures, 1:2 cobalt complex formazan dyes and their use CIBA GEIGY AG (CH) 1999-09-01 EP disclosed
EP-0625550-A1 Dye mixtures, 1:2 cobalt complex formazan dyes and their use CIBA-GEIGY AG (CH) 1994-11-23 EP disclosed