SCHEMBL1592415

SCHEMBL1592415

CC(C)(C)CC(C)(C)c1ccc(OCCCCO)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.81
SMN1; SMN2 Q16637 3/20 0.81
SHBG P04278 1/20 0.50
HRH3 Q9Y5N1 10/20 0.47
HIF1A Q16665 4/20 0.47
MEN1 O00255 2/20 0.47
APAF1 O14727 2/20 0.47
USP2 O75604 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
ERBB2 P04626 2/20 0.47
TP53 P04637 2/20 0.47
FYN P06241 2/20 0.47
CHRM2 P08172 2/20 0.47
CHRM4 P08173 2/20 0.47
CHRM5 P08912 2/20 0.47
ADRA2A P08913 2/20 0.47
MAPT P10636 2/20 0.47
HSPD1 P10809 2/20 0.47
CHRM1 P11229 2/20 0.47

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
SCHEMBL2108029 0.95 CYP3A4 (0.84) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
Triton X SCHEMBL33822 0.90 CYP3A4 (1.00) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
Triton X SCHEMBL21176032 0.90 CYP3A4 (1.00) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
Triton X SCHEMBL5933893 0.87 CYP3A4 (0.93) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
Triton X SCHEMBL15135853 0.87 CYP3A4 (0.93) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
1,4-Butanediol SCHEMBL1592411 0.86 CYP3A4 (0.65) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
SCHEMBL20168125 0.84 CYP3A4 (0.82) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
SCHEMBL2961794 0.84 CYP3A4 (0.82) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
SCHEMBL16198907 0.84 CYP3A4 (0.82) CYP3A4SMN1; SMN2SHBGHRH3HIF1A
SCHEMBL13932430 0.84 CYP3A4 (0.82) CYP3A4SMN1; SMN2SHBGHRH3HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8349766-B2 Thermosensitive recording material FUJIFILM CORPORATION (JP) 2013-01-08 US disclosed
US-20110092365-A1 THERMOSENSITIVE RECORDING MATERIAL FUJIFILM CORPORATION (JP) 2011-04-21 US disclosed
US-20100048395-A1 THERMOSENSITIVE RECORDING MATERIAL FUJIFILM CORPORATION (JP) 2010-02-25 US disclosed
US-7192904-B2 Thermal recording material FUJI PHOTO FILM CO., LTD. (JP) 2007-03-20 US disclosed
EP-1466753-B1 THERMAL RECORDING MATERIAL FUJI PHOTO FILM CO LTD (JP) 2007-02-14 EP disclosed
US-7098168-B2 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 2006-08-29 US disclosed
US-20060046933-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 2006-03-02 US disclosed
US-20050170959-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 2005-08-04 US disclosed
US-20050088508-A1 Heat-sensitive recording material FUJIFILM CORPORATION (JP) 2005-04-28 US disclosed
US-20050054527-A1 Thermal recording material FUJIFILM CORPORATION (JP) 2005-03-10 US disclosed
EP-1466751-A1 HEAT-SENSITIVE RECORDING MATERIAL Fuji Photo Film Co., Ltd. (JP) 2004-10-13 EP disclosed
EP-1466750-A1 HEAT-SENSITIVE RECORDING MATERIAL Fuji Photo Film Co., Ltd. (JP) 2004-10-13 EP disclosed
EP-1466753-A1 THERMAL RECORDING MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 2004-10-13 EP disclosed
EP-1466752-A1 HEAT-SENSITIVE RECORDING MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 2004-10-13 EP disclosed
US-6642175-B2 Comprising a support, an electron-donating leuco-dye, an electron-receiving compound, such as 2-benzyloxynaphthalene, a sensitizer and stabilizer; capable of forming high-density color images with little background fogging FUJI PHOTO FILM CO., LTD. (JP) 2003-11-04 US disclosed
US-20020065195-A1 Heat -sensitive recording material FUJI PHOTO FILM CO., LTD. 2002-05-30 US disclosed
EP-1195260-A2 Heat-sensitive recording material Fuji Photo Film Co., Ltd. (JP) 2002-04-10 EP disclosed
US-4987117-A MICROPOROUS LAYER OF SYNTHETIC RESIN OR CELLULOSE DERIVATIVE BETWEEN SUPPORT AND RECORDING LAYER FUJI PHOTO FILM CO., LTD. (JP) 1991-01-22 US disclosed
US-4923844-A LAYER WITH POROUS GRAINS BOUND TO SURFACE OF CORE; HIGH DENSITY, LOW ENERGY FUJI PHOTO FILM CO., LTD. (JP) 1990-05-08 US disclosed