SCHEMBL1596746

SCHEMBL1596746

O=S(=O)(CCl)c1ccc(CBr)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 2/20 0.41
PLCG1 P19174 1/20 0.40
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
TRPA1 O75762 1/20 0.37
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
CA2 P00918 9/20 0.34
CA1 P00915 6/20 0.34
CA9 Q16790 5/20 0.34
CA7 P43166 4/20 0.34
CA12 O43570 4/20 0.34
CA4 P22748 3/20 0.34
CA6 P23280 3/20 0.34
CA5A P35218 3/20 0.34
CA14 Q9ULX7 3/20 0.34
CA5B Q9Y2D0 3/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL1595559 0.82 CA2 (0.45) PSIP1PLCG1ALDH1A1TSHRCA2
SCHEMBL1939488 0.80 PSIP1 (0.63) PSIP1PLCG1ALDH1A1TSHRTRPA1
SCHEMBL15212213 0.78 PSIP1 (0.41) PSIP1PLCG1ALDH1A1TSHRTRPA1
SCHEMBL297518 0.77 ALDH1A1 (0.48) PSIP1PLCG1ALDH1A1TSHRTRPA1
SCHEMBL165340 0.77 PLCG1 (0.67) PLCG1CA2CA1CA9CA12
SCHEMBL1148233 0.77 HTR6 (0.47) PSIP1ALDH1A1TSHRTRPA1CES2
Hydrochloric Acid SCHEMBL10645058 0.76 ALDH1A1 (0.46) PSIP1ALDH1A1TSHRTRPA1CES2
SCHEMBL1941301 0.75 PSIP1 (0.47) PSIP1PLCG1ALDH1A1CA2CYP3A4
SCHEMBL2914219 0.75 ALDH1A1 (0.56) ALDH1A1CES1CA2CA1CA9
SCHEMBL8996770 0.75 TSHR (0.42) PSIP1PLCG1ALDH1A1TSHRTRPA1

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
EP-1780224-B1 MULTIBRANCHED POLYMERS AND PROCESS FOR PRODUCTION THEREOF NIPPON SODA CO (JP) 2015-02-18 EP disclosed
US-8710165-B2 Multibranched polymer and method for producing the same NIPPON SODA CO., LTD. (JP) 2014-04-29 US disclosed
US-20110152388-A1 Multibranched polymer and method for producing the same NIPPON SODA CO., LTD. (JP) 2011-06-23 US disclosed
US-7919570-B2 narrowly dispersed; controlled molecular weight; ionic conductivity, shape stability; battery adhesive or binder; 1,1,2,2-tetrakis(4-hydroxyphenyl)ethane or pentaerythritol reacted with bromoisobutyroyl bromide for core; living radical polymerization of acrylate or a styrene at halogen atoms as the arms NIPPON SODA CO., LTD. (JP) 2011-04-05 US disclosed
US-20080214685-A1 Multibrached Polymer and Method for Producing the Same NIPPON SODA CO., LTD. (JP) 2008-09-04 US disclosed
EP-1780224-A1 MULTIBRANCHED POLYMERS AND PROCESS FOR PRODUCTION THEREOF NIPPON SODA CO., LTD. (JP) 2007-05-02 EP disclosed