SCHEMBL604740

SCHEMBL604740

C=C(C#N)C(=O)Oc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
HPGD P15428 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ELANE P08246 2/20 0.45
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALOX15 P16050 2/20 0.39
CYP19A1 P11511 1/20 0.39
MAOB P27338 1/20 0.39
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
NSD2 O96028 1/20 0.37

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
SCHEMBL28040187 0.95 HSD17B10 (0.44) HSD17B10NPC1RAB9AHPGDCYP1A2
SCHEMBL9514642 0.83 ELANE (0.56) HSD17B10NPC1RAB9AHPGDCYP1A2
SCHEMBL5012586 0.83 ALDH1A1 (0.40) HSD17B10NPC1RAB9AHPGDCYP3A4
SCHEMBL28237096 0.83 MAOB (0.54) NPC1RAB9ACYP1A2CYP2C19MAOB
Benzoic Acid SCHEMBL28645605 0.82 ELANE (0.48) HSD17B10NPC1RAB9AELANEALDH1A1
SCHEMBL28459480 0.81 ALDH1A1 (0.39) HSD17B10NPC1RAB9AHPGDCYP1A2
SCHEMBL2445881 0.81 LMNA (0.50) CYP1A2CYP2C9CYP2C19ELANEALDH1A1
SCHEMBL28040189 0.79 HSD17B10 (0.38) HSD17B10NPC1RAB9AHPGDCYP1A2
Benzoic Acid SCHEMBL28637057 0.79 CES2 (0.44) HSD17B10NPC1RAB9AELANETSHR
SCHEMBL8956718 0.78 ALDH1A1 (0.40) HSD17B10NPC1RAB9AHPGDCYP1A2

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 287 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8651185-B2 Reducing or stopping the uncontrolled flow of fluid such as oil from a well LOS ALAMOS NATIONAL SECURITY, LLC (US) 2014-02-18 US claimed
US-20120285683-A1 REDUCING OR STOPPING THE UNCONTROLLED FLOW OF FLUID SUCH AS OIL FROM A WELL LOS ALAMOS NATIONAL SECURITY, LLC (US) 2012-11-15 US claimed
CN-101544669-B Phenyl cyanoacrylate derivatives containing alpha-amino phosphonate ester and preparation method and application thereof UNIV GUIZHOU 2011-09-07 CN claimed
CN-100564426-C Water-soluble polyamioamides as sunscreen agents NALCO CO (US) 2009-12-02 CN claimed
CN-101544669-A Phenyl cyanoacrylate derivatives containing alpha-amino phosphonate ester and preparation method and application thereof UNIV GUIZHOU 2009-09-30 CN claimed
EP-1481800-B1 Thermally sensitive compositions containing cyanoacrylate polymers EASTMAN KODAK CO (US) 2008-12-24 EP claimed
EP-1481801-B1 Top coat layer for thermally sensitive printing plate precursors EASTMAN KODAK CO (US) 2007-08-08 EP claimed
CN-1239653-C Cyanoacrylate compositions, reaction products, methods of preparation and uses thereof LOCTITE R & D LTD (IE) 2006-02-01 CN claimed
US-6924080-B2 A light to heat conversion coating and polycyanoacrylate particles having an average major dimension of <350 nm; developed \"on press\" by fountain solution and/or printing ink used in a part of the printing process; free of free-radical initiators KODAK POLYCHROME GRAPHICS LLC (US) 2005-08-02 US claimed
US-20040241572-A1 TOP COAT LAYER FOR APPLICATION OVER A POLYCYANOACRYLATE-CONTAINING THERMALLY SENSITIVE LAYER THAT REDUCES ABLATION WITHOUT ADVERSELY INTERACTING WITH THE THERMALLY SENSITIVE LAYER AND WITHOUT ADVERSELY AFFECTING NPEC INC. 2004-12-02 US claimed
US-6602970-B2 A 2-cyanoacrylate composition has high curing rate and excellent moisture resistance, surface curability containing a cyclic phenol sulfide derivative TOAGOSEI CO., LTD. (JP) 2003-08-05 US claimed
US-6551757-B1 Can be used as a lithographic printing plate without ablation EASTMAN KODAK COMPANY 2003-04-22 US claimed
US-20030064317-A1 Spray coating a dispersion of polymethylcyanoacrylate, photothermal conversion material (infrared radiation cyanine dye, and binder for exposure of lithographic printing plate EASTMAN KODAK COMPANY 2003-04-03 US claimed
US-5665107-A Surface opening adhesive sealer HEMODYNAMICS, INC. (US) 1997-09-09 US claimed
US-5653730-A Surface opening adhesive sealer HEMODYNAMICS, INC. (US) 1997-08-05 US claimed
US-5529577-A Surface opening adhesive sealer HEMODYNAMICS, INC. (US) 1996-06-25 US claimed
US-5383899-A Method of using a surface opening adhesive sealer HEMODYNAMICS, INC. 1995-01-24 US claimed
US-4393183-A STORAGE STABILITY, BONDING STRENGTH TOAGOSEI CHEMICAL INDUSTRY CO., LTD. (JP) 1983-07-12 US claimed
US-4313865-A A Z-CYANOACRYLATE AND A 1,1-OISUBSTITUTED DIENE PROVIDES FLEXIBILITY, HEAT RESISTANCE, IMPACT RESISTANCE, PEEL RESISTANCE AND WATER RESISTANCE JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1982-02-02 US claimed
EP-0026665-A1 Quick-setting adhesive composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1981-04-08 EP claimed