SCHEMBL8967450

SCHEMBL8967450

N#CC(C#N)=C(C#N)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.43
CES2 O00748 1/20 0.43
AKR1B1 P15121 1/20 0.43
ALDH1A1 P00352 3/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP1B1 Q16678 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
KDM4E B2RXH2 1/20 0.37
TSHR P16473 1/20 0.37
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CTBP2 P56545 1/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL14194428 0.81 CES2 (0.41) CES1CES2AKR1B1ALDH1A1CYP1A1
SCHEMBL11131330 0.81 CYP1A1 (0.42) CES1CES2AKR1B1ALDH1A1CYP1A1
SCHEMBL3945284 0.80 KDM4E (0.45) CES1CES2AKR1B1ALDH1A1CYP1A1
SCHEMBL11765098 0.77 CES1 (0.41) CES1CES2AKR1B1ALDH1A1CYP1A1
SCHEMBL11010613 0.77 CES2 (0.41) CES1CES2AKR1B1ALDH1A1CYP1A1
SCHEMBL9657223 0.77 KMT2A (0.41) CES1CES2AKR1B1ALDH1A1CYP1A1
SCHEMBL16550069 0.75 ALDH1A1 (0.43) CES1CES2AKR1B1ALDH1A1CYP1A1
SCHEMBL3937328 0.72 ALDH1A1 (0.39) CES1CES2AKR1B1ALDH1A1MEN1
SCHEMBL1120119 0.71 CA1 (0.40) CES1CES2AKR1B1ALDH1A1MEN1
SCHEMBL1120121 0.71 CA1 (0.40) CES1CES2AKR1B1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0524637-B1 Mixture of dyes for cyan dye donor for thermal color proofing EASTMAN KODAK CO (US) 1996-03-06 EP disclosed
EP-0530801-B1 Mixture of dyes for black dye donor for thermal color proofing EASTMAN KODAK CO (US) 1996-03-06 EP disclosed
EP-0483791-B1 Cyan azamethine dye-donor element for thermal dye transfer EASTMAN KODAK CO (US) 1995-12-27 EP disclosed
EP-0530800-B1 Mixture of dyes for black dye donor for thermal color proofing EASTMAN KODAK CO (US) 1995-12-06 EP disclosed
EP-0530798-B1 Mixture of dyes for black dye donor for thermal color proofing EASTMAN KODAK CO (US) 1995-12-06 EP disclosed
EP-0530799-B1 Mixture of dyes for black dye donor for thermal color proofing EASTMAN KODAK CO (US) 1995-11-29 EP disclosed
EP-0530802-B1 Mixture of dyes for black dye donor for thermal color proofing EASTMAN KODAK CO (US) 1995-11-29 EP disclosed
WO-1995020181-A1 METHINE DYES FOR NON-LINEAR OPTICS BASF AKTIENGESELLSCHAFT (DE) 1995-07-27 WO disclosed
EP-0483793-B1 Mixture of dyes for cyan dye donor for thermal color proofing EASTMAN KODAK CO (US) 1995-03-29 EP disclosed
EP-0537755-B1 High viscosity binders for thermal dye transfer dye-donors EASTMAN KODAK CO (US) 1995-03-15 EP disclosed
US-5134115-A Heat transfer element for thermal prints EASTMAN KODAK COMPANY (US) 1992-07-28 US disclosed
US-5134116-A Mixture of dyes for black dye donor for thermal color proofing EASTMAN KODAK COMPANY (US) 1992-07-28 US disclosed
US-5126312-A Storage stability; high image density EASTMAN KODAK COMPANY (US) 1992-06-30 US disclosed
US-5126313-A Storage stability; high density images EASTMAN KODAK COMPANY (US) 1992-06-30 US disclosed
US-5126314-A Storage stability; high density images EASTMAN KODAK COMPANY (US) 1992-06-30 US disclosed
US-5126311-A Storage stability; high density images EASTMAN KODAK COMPANY (US) 1992-06-30 US disclosed
EP-0483876-A1 Mixture of dyes for black dye donor for thermal color proofing EASTMAN KODAK COMPANY (US) 1992-05-06 EP disclosed
EP-0483791-A1 Cyan azamethine dye-donor element for thermal dye transfer EASTMAN KODAK COMPANY (US) 1992-05-06 EP disclosed
EP-0483793-A1 Mixture of dyes for cyan dye donor for thermal color proofing EASTMAN KODAK COMPANY (US) 1992-05-06 EP disclosed
US-5024990-A Accuracy EASTMAN KODAK COMPANY (US) 1991-06-18 US disclosed