SCHEMBL4696344

SCHEMBL4696344

COCCOCCOCc1cc(=O)oc2cc(N)ccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 4/20 0.54
KDM4E B2RXH2 7/20 0.50
ALDH1A1 P00352 6/20 0.50
GAA P10253 4/20 0.50
HPGD P15428 3/20 0.50
GLA P06280 2/20 0.50
CASP1 P29466 2/20 0.50
CASP7 P55210 2/20 0.50
HSD17B10 Q99714 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA9 Q16790 1/20 0.50
MEN1 O00255 1/20 0.44
SRC P12931 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TLR9 Q9NR96 1/20 0.44
POLB P06746 1/20 0.43
CYP2D6 P10635 2/20 0.43

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
SCHEMBL655278 0.86 HSD17B3 (0.71) HSD17B3KDM4EALDH1A1GAAHPGD
SCHEMBL9154997 0.86 HSD17B3 (0.75) HSD17B3KDM4EALDH1A1GAAHPGD
SCHEMBL8795011 0.82 HSD17B3 (0.52) HSD17B3KDM4EALDH1A1GAAHPGD
SCHEMBL9301272 0.81 ALDH1A1 (0.58) HSD17B3KDM4EALDH1A1GAAHPGD
SCHEMBL8795371 0.79 MCL1 (0.56) HSD17B3KDM4EALDH1A1GAAHPGD
SCHEMBL5138290 0.77 HSD17B3 (0.66) HSD17B3KDM4EALDH1A1GAAHPGD
SCHEMBL7037768 0.75 HSD17B3 (0.51) HSD17B3KDM4EALDH1A1GAAHPGD
SCHEMBL7919717 0.74 KDM4E (0.74) HSD17B3KDM4EALDH1A1GAAHPGD
SCHEMBL8594115 0.74 HSD17B3 (0.68) HSD17B3KDM4EALDH1A1GAAHPGD
Hydrochloric Acid SCHEMBL9300196 0.73 POLB (0.50) HSD17B3KDM4EALDH1A1GAAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754179-B2 Light activated shape memory co-polymers CORNERSTONE RESEARCH GROUP, INC. (US) 2014-06-17 US disclosed
US-20080021166-A1 Light Activated Shape Memory Co-Polymers GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2008-01-24 US disclosed
EP-1799771-A2 LIGHT ACTIVATED SHAPE MEMORY CO-POLYMERS CORNERSTONE RESEARCH GROUP, INC. (US) 2007-06-27 EP disclosed
WO-2007001407-A2 LIGHT ACTIVATED SHAPE MEMORY CO-POLYMERS CORNERSTONE RESEARCH GROUP, INC. (US) 2007-01-04 WO disclosed
EP-0645386-B1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1997-12-29 EP disclosed
EP-0516532-B1 Watersoluble coumarin derivatives, their preparation and their use as enzyme substrates or for the preparation of those substrates EUROBIO LAB (FR) 1997-01-15 EP disclosed
EP-0645386-A1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1995-03-29 EP disclosed
US-5342970-A Hydrosoluble coumarin derivatives, their preparation and their use as an enzyme substrate or for the preparation of such substrates LABORATOIRES EUROBIO (FR) 1994-08-30 US disclosed
EP-0516532-A1 Watersoluble coumarin derivatives, their preparation and their use as enzyme substrates or for the preparation of those substrates LABORATOIRES EUROBIO (FR) 1992-12-02 EP disclosed