SCHEMBL1373399

SCHEMBL1373399

O=C(O)c1c[c]c(S(=O)(=O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
TP53 P04637 1/20 0.42
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
CA1 P00915 4/20 0.39
CA2 P00918 4/20 0.39
CA12 O43570 3/20 0.39
CA9 Q16790 3/20 0.39
CA14 Q9ULX7 3/20 0.39
CA3 P07451 2/20 0.39
CA6 P23280 2/20 0.39
CA5A P35218 2/20 0.39
CA7 P43166 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
CYP2C19 P33261 1/20 0.39
SRD5A2 P31213 2/20 0.38
HSD17B10 Q99714 1/20 0.37
TYR P14679 1/20 0.37
DRD1 P21728 1/20 0.37
CA4 P22748 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
SCHEMBL6631406 0.72 LMNA (0.44) TSHRTP53CA1CA2CA12
SCHEMBL1376847 0.72 LMNA (0.44) TSHRLCKFYNCA1CA2
SCHEMBL578580 0.72 TSHR (0.52) TSHRTP53CA1CA2CA12
SCHEMBL3914014 0.71 ALDH1A1 (0.46) TSHRCA1CA2CA12CA9
SCHEMBL7047732 0.71 GAA (0.34) TSHRCA1CA2CA12CA9
SCHEMBL5503632 0.71 CYP3A4 (0.34) TSHRCA1CA2CA12CA9
SCHEMBL1373279 0.71 LCK (0.44) TSHRTP53LCKFYNCA1
Terephthalic Acid SCHEMBL17210199 0.70 TSHR (0.75) TSHRTP53CA1CA2CA12
SCHEMBL2780243 0.70 TSHR (0.50) TSHRTP53CA1CA2CA12
SCHEMBL1869090 0.68 ALDH1A1 (0.50) TSHRTP53CA1CA2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5281263-A Disazo dyes for inks printed paper IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-25 US claimed
EP-2391683-B1 FIBER-REACTIVE COPPER COMPLEX DISAZO DYES DYSTAR COLOURS DISTRIB GMBH (DE) 2017-03-29 EP disclosed
US-9062208-B2 Fiber-reactive copper complex disazo dyes DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2015-06-23 US disclosed
US-20110283465-A1 FIBER-REACTIVE COPPER COMPLEX DISAZO DYES DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2011-11-24 US disclosed
WO-2010086243-A2 FIBER-REACTIVE COPPER COMPLEX DISAZO DYES DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2010-08-05 WO disclosed
EP-0840766-B1 STABILISED DYE COMPOSITION AVECIA LTD (GB) 2001-08-29 EP disclosed
US-5869627-A WATER SOLUBLE BIS-AZO DYE ZENECA LIMITED (GB) 1999-02-09 US disclosed
EP-0759956-B1 DISAZO COMPOUND ZENECA LTD (GB) 1998-10-07 EP disclosed
US-5756693-A BLACK COLORANT FOR INK JET PRINTING ZENECA LIMITED (DE) 1998-05-26 US disclosed
EP-0840766-A1 STABILISED DYE COMPOSITION ZENECA LIMITED (GB) 1998-05-13 EP disclosed
EP-0759956-A1 DISAZO COMPOUND ZENECA LIMITED (GB) 1997-03-05 EP disclosed
WO-1997003132-A1 STABILISED DYE COMPOSITION ZENECA LIMITED (GB) 1997-01-30 WO disclosed
EP-0572419-B1 ANIONIC DISAZO DYES ZENECA LTD (GB) 1996-11-13 EP disclosed
WO-1996013553-A1 DISARO COLORANT ZENECA LIMITED (GB) 1996-05-09 WO disclosed
WO-1995031505-A1 DISAZO COMPOUND ZENECA LIMITED (GB) 1995-11-23 WO disclosed
US-5281263-A Disazo dyes for inks printed paper IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-25 US disclosed
EP-0572419-A1 ANIONIC DISAZO DYES. ZENECA LTD (GB) 1993-12-08 EP disclosed
WO-1992013037-A1 ANIONIC DISAZO DYES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-08-06 WO disclosed