SCHEMBL4749320

SCHEMBL4749320

CCC(C)(C)OCC(C)OCC(C)O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL4751940 0.98 TDP1 (0.48) TDP1MAPK1HSD17B10ALDH1A1TSHR
SCHEMBL756796 0.85 MAPK1 (0.61) TDP1MAPK1HSD17B10ALDH1A1TSHR
SCHEMBL78969 0.81 MAPK1 (0.70) TDP1MAPK1HSD17B10
SCHEMBL3395409 0.79 MAPK1 (0.67) TDP1MAPK1HSD17B10
SCHEMBL350593 0.79 MAPK1 (0.67) TDP1MAPK1HSD17B10
SCHEMBL23059731 0.77 TDP1 (0.37) TDP1
SCHEMBL15255396 0.75 TDP1 (0.42) TDP1MAPK1
SCHEMBL14607257 0.74 ALDH1A1 (0.36) TDP1MAPK1ALDH1A1TSHR
SCHEMBL25658298 0.73 DNM1 (0.36) TDP1ALDH1A1
SCHEMBL13863409 0.72 ALDH1A1 (0.35) TDP1MAPK1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008135801-A2 ADJUSTABLE FUEL POWER BOOSTER COMPONENT COMPOSITION ARAYA BRENES MARIO (CR) 2008-11-13 WO disclosed
US-20070204506-A1 ADJUSTABLE FUEL POWER BOOSTER COMPONENT COMPOSITION BRENES MARIO A 2007-09-06 US disclosed
US-20070130822-A1 ALCOHOL BASED FUEL AND/OR BIOFUEL COMPOSITION ARAYA MARIO 2007-06-14 US disclosed
WO-2006051424-A9 ALCOHOL BASED FUEL AND/OR BIOFUEL COMPOSITION ARAYA BRENES MARIO (CR) 2006-08-24 WO disclosed
WO-2006051424-A1 ALCOHOL BASED FUEL AND/OR BIOFUEL COMPOSITION ARAYA BRENES MARIO (CR) 2006-05-18 WO disclosed
EP-1022300-B1 CATALYST FOR RING-OPENING POLYMERIZATION OF ALKYLENE OXIDE, METHOD FOR PREPARATION THEREOF AND USE THEREOF ASAHI GLASS CO LTD (JP) 2004-09-29 EP disclosed
US-6313060-B1 Catalyst for ring-opening polymerization of alkylene oxide, method for preparation thereof and use thereof ASAHI GLASS COMPANY, LIMITED (JP) 2001-11-06 US disclosed
EP-1022300-A1 CATALYST FOR RING-OPENING POLYMERIZATION OF ALKYLENE OXIDE, METHOD FOR PREPARATION THEREOF AND USE THEREOF ASAHI GLASS COMPANY LTD. (JP) 2000-07-26 EP disclosed
US-5821016-A PHOTOPOLYMERIZATION OF UNSATURATED BOND IN COPOLYMERS WITH CARBOXYL GROUPS, PIGMENTS AND OPTICAL SENSITIZERS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-10-13 US disclosed
US-5425790-A Containing a polyethylene oxide fuel additive ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1995-06-20 US disclosed
US-5314511-A Fuel additives ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1994-05-24 US disclosed