SCHEMBL3894773

SCHEMBL3894773

CCN(CC)c1ccc(C(c2ccc(N(C)CCC#N)cc2)c2ccc(N(C)CCC#N)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 2/20 0.41
THRB P10828 1/20 0.41
GRK6 P43250 2/20 0.40
TSHR P16473 2/20 0.39
MAPT P10636 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
MAPK1 P28482 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
PSMD14 O00487 1/20 0.37
CYP3A4 P08684 1/20 0.37
RECQL P46063 1/20 0.37
GFER P55789 1/20 0.37
CNR2 P34972 5/20 0.36

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
SCHEMBL3895327 0.87 GRK6 (0.41) ALDH1A1MEN1KMT2AKDM4ETHRB
SCHEMBL3204526 0.87 CRHR1 (0.39) ALDH1A1MEN1KMT2AKDM4ETHRB
SCHEMBL12374444 0.80 GRK6 (0.49) ALDH1A1KDM4EGRK6TSHRMAPK1
SCHEMBL131813 0.78 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AKDM4EGRK6
SCHEMBL5665672 0.76 CYP19A1 (0.47) ALDH1A1MEN1KMT2AKDM4EGRK6
SCHEMBL3894772 0.75 GAA (0.41) ALDH1A1MEN1KMT2AKDM4ETHRB
SCHEMBL11289144 0.75 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AKDM4ETHRB
SCHEMBL9699686 0.75 SLC2A1 (0.55) ALDH1A1KDM4EGRK6TSHRMAPT
SCHEMBL5007896 0.75 SLC2A1 (0.55) ALDH1A1KDM4EGRK6TSHRMAPT
SCHEMBL5011804 0.75 SLC2A1 (0.55) ALDH1A1KDM4EGRK6TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765592-B1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2009-01-28 EP disclosed
US-20080311524-A1 Method For Making Negative-Working Heat-Sensitive Lithographic Printing Plate Precursor AGFA GRAPHICS N.V. (BE) 2008-12-18 US disclosed
EP-1803034-A2 HOLOGRAPHIC STORAGE MEDIUM General Electric Company (US) 2007-07-04 EP disclosed
WO-2006044243-A2 HOLOGRAPHIC STORAGE MEDIUM GENERAL ELECTRIC COMPANY A CORPORATION OF THE STATE OF NEW YORK (US) 2006-04-27 WO disclosed
US-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 US disclosed
EP-1614541-A2 Method of making a lithographic printing plate. Agfa-Gevaert (BE) 2006-01-11 EP disclosed
US-4857438-A Photochromic system and layers produced therewith BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed
US-4139390-A Presensitized printing plate having a print-out image EASTMAN KODAK COMPANY (US) 1979-02-13 US disclosed