SCHEMBL6691473

SCHEMBL6691473

CCCCCCCCCCCCSS(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.47
CES2 O00748 3/20 0.43
TP53 P04637 2/20 0.43
THRB P10828 2/20 0.43
GMNN O75496 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
CYP2C9 P11712 1/20 0.43
BLM P54132 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CA1 P00915 2/20 0.42
PPARA Q07869 2/20 0.40
EPHX1 P07099 1/20 0.39
FAAH O00519 6/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CES1 P23141 4/20 0.38
PLA2G6 O60733 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL4101877 1.00 CA2 (0.47) CA2CES2TP53THRBGMNN
SCHEMBL15500216 1.00 CA2 (0.47) CA2CES2TP53THRBGMNN
SCHEMBL11333558 0.98 CA2 (0.45) CA2CES2TP53THRBGMNN
SCHEMBL27617655 0.98 CA2 (0.45) CA2CES2TP53THRBGMNN
SCHEMBL11340050 0.98 CA2 (0.45) CA2CES2TP53THRBGMNN
SCHEMBL6687367 0.98 CA2 (0.45) CA2CES2TP53THRBGMNN
SCHEMBL327328 0.98 CA2 (0.43) CA2CES2TP53THRBGMNN
SCHEMBL5029419 0.90
SCHEMBL10957642 0.88 HSD17B10 (0.38) CA2CES2TP53THRBGMNN
SCHEMBL1082107 0.87 TP53 (0.38) CA2CES2TP53THRBGMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104017669-A Automobile engine cleansing agent CHEN JIANBAO 2014-09-03 CN claimed
WO-2004096864-A2 RUBBER COMPOSITION CONTAINING A SILICA DISPERSION AGENT EKT TECHNOLOGIES, LLC (US) 2004-11-11 WO claimed
US-20040214929-A1 Rubber composition containing a silica dispersion agent BRADLEY ROBERT (US) 2004-10-28 US claimed
CN-104017669-A Automobile engine cleansing agent CHEN JIANBAO 2014-09-03 CN disclosed
CN-103011884-A Preparation method of corundum/mullite light-weight heat insulating material SINOSTEEL LUOYANG INST OF REFRACTORIES RES CO LTD 2013-04-03 CN disclosed
WO-2004096864-A2 RUBBER COMPOSITION CONTAINING A SILICA DISPERSION AGENT EKT TECHNOLOGIES, LLC (US) 2004-11-11 WO disclosed
US-20040214929-A1 Rubber composition containing a silica dispersion agent BRADLEY ROBERT (US) 2004-10-28 US disclosed
EP-0773778-B1 HAIR STYLING COMPOSITION AND METHOD UNILEVER PLC (GB) 1999-03-31 EP disclosed