SCHEMBL18207993

SCHEMBL18207993

CCCCCCCCCCCCSCC(=O)[O-].CCCCCCCCCCCCSCC(=O)[O-].C[Sn+2]C

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.60
GMNN O75496 1/20 0.60
TP53 P04637 1/20 0.60
POLB P06746 1/20 0.60
MAPT P10636 1/20 0.60
THRB P10828 1/20 0.60
CYP2C9 P11712 1/20 0.60
BLM P54132 1/20 0.60
HSD17B10 Q99714 1/20 0.60
CES1 P23141 8/20 0.53
FAAH O00519 4/20 0.53
PLA2G6 O60733 1/20 0.53
CA2 P00918 1/20 0.40
FABP3 P05413 3/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL18207969 1.00 CES2 (0.60) CES2GMNNTP53POLBMAPT
SCHEMBL18207978 1.00 CES2 (0.60) CES2GMNNTP53POLBMAPT
SCHEMBL18207972 1.00 CES2 (0.60) CES2GMNNTP53POLBMAPT
Tetradecylthioacetic Acid SCHEMBL18832763 1.00 CES2 (0.60) CES2GMNNTP53POLBMAPT
SCHEMBL16344627 1.00 CES2 (0.60) CES2GMNNTP53POLBMAPT
SCHEMBL18207966 1.00 CES2 (0.60) CES2GMNNTP53POLBMAPT
SCHEMBL18207951 1.00 CES2 (0.60) CES2GMNNTP53POLBMAPT
SCHEMBL18207957 0.98 CES2 (0.57) CES2GMNNTP53POLBMAPT
SCHEMBL7112737 0.92 CES2 (0.64) CES2GMNNTP53POLBMAPT
Silver SCHEMBL11812496 0.92 CES2 (0.64) CES2GMNNTP53POLBMAPT

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
US-10988566-B2 Delayed action gelling catalyst compositions and methods for making polyurethane polymers EVONIK OPERATIONS GMBH (DE) 2021-04-27 US claimed
US-10988566-B2 Delayed action gelling catalyst compositions and methods for making polyurethane polymers EVONIK OPERATIONS GMBH (DE) 2021-04-27 US disclosed
EP-3292162-B1 DELAYED ACTION GELLING CATALYST COMPOSITIONS AND METHODS FOR MAKING POLYURETHANE POLYMERS EVONIK OPERATIONS GMBH (DE) 2021-01-20 EP disclosed
US-20190016844-A1 DELAYED ACTION GELLING CATALYST COMPOSITIONS AND METHODS FOR MAKING POLYURETHANE POLYMERS EVONIK OPERATIONS GMBH (DE) 2019-01-17 US disclosed
US-10081700-B2 Delayed action gelling catalyst compositions and methods for making polyurethane polymers EVONIK DEGUSSA GMBH (DE) 2018-09-25 US disclosed
EP-3292162-A1 DELAYED ACTION GELLING CATALYST COMPOSITIONS AND METHODS FOR MAKING POLYURETHANE POLYMERS Evonik Degussa GmbH (DE) 2018-03-14 EP disclosed
WO-2016178793-A1 DELAYED ACTION GELLING CATALYST COMPOSITIONS AND METHODS FOR MAKING POLYURETHANE POLYMERS AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-11-10 WO disclosed
US-20160326297-A1 DELAYED ACTION GELLING CATALYST COMPOSITIONS AND METHODS FOR MAKING POLYURETHANE POLYMERS AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-11-10 US disclosed