SCHEMBL4811212

SCHEMBL4811212

CNCCCn1c(O)cc(C)cc1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
WEE1 P30291 3/20 0.38
ADRA2A P08913 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
ALDH1A1 P00352 3/20 0.35
RXRA P19793 3/20 0.35
IDH1 O75874 3/20 0.35
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.34
ALOX15 P16050 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CHEK1 O14757 2/20 0.34
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33

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
SCHEMBL11326890 0.90 IDH1 (0.37) KDM4EMEN1KMT2AMAPTADRA2A
SCHEMBL11313630 0.81 KDM4E (0.55) KDM4EMEN1KMT2AMAPTALDH1A1
SCHEMBL10533316 0.81 ALDH1A1 (0.49) KDM4EMEN1KMT2AMAPTADRA2A
SCHEMBL10800568 0.79 PGK1 (0.38) KDM4EMEN1KMT2AMAPTIDH1
SCHEMBL11318676 0.79 ADRA2A (0.47) KDM4EMEN1KMT2AMAPTADRA2A
SCHEMBL10531764 0.78 POLB (0.43) KDM4EMEN1KMT2AMAPTADRA2A
SCHEMBL7893096 0.78 KDM4E (0.53) KDM4EMEN1KMT2AMAPTALDH1A1
SCHEMBL10586953 0.77 ALDH1A1 (0.44) KDM4EMEN1KMT2AMAPTALDH1A1
SCHEMBL14181326 0.76 KDM4E (0.47) KDM4EMEN1KMT2AMAPTWEE1
SCHEMBL7893162 0.76 KDM4E (0.47) KDM4EMEN1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6220348-A None JP disclosed
JP-6271784-A None JP disclosed
US-7371831-B2 Polyazo, disazo, trisazo, triazine, hair and cationic dyes CLARIANT FINANCE (BVI) LIMITED (VG) 2008-05-13 US disclosed
EP-1360242-B1 AZO DYESTUFFS CLARIANT FINANCE BVI LTD (VG) 2006-11-08 EP disclosed
US-20040083924-A1 Azo dyestuffs ARCHROMA IP GMBH (CH) 2004-05-06 US disclosed
EP-1360242-A1 AZO DYESTUFFS Clariant International Ltd. (CH) 2003-11-12 EP disclosed
WO-2002062902-A1 AZO DYESTUFFS CLARIANT FINANCE (BVI) LIMITED (VG) 2002-08-15 WO disclosed
US-6140478-A SUITABLE FOR COLORING OR PRINTING ESPECIALLY OF PAPER AND LEATHER. CLARIANT FINANCE (BVI) LIMITED 2000-10-31 US disclosed
EP-0611259-B1 Fibre-reactive phthalocyanine dyes CLARIANT FINANCE BVI LTD (VG) 1998-07-01 EP disclosed
US-5760215-A BASED ON ALUMINUM PHTHALOCYANINE; DYE COTTON BRILLIANT GREEN COLORFAST SHADES CLARIANT FINANCE (BVI) LIMITED (VG) 1998-06-02 US disclosed
US-5527886-A MONO-DI OR POLYAZO DYES; COLORFASTNESS SANDOZ LTD. (CH) 1996-06-18 US disclosed
JP-H06271784-A FIBER-REACTIVE PHTHALOCYANINE DYE AND ITS PRODUCTION SANDOZ AG 1994-09-27 JP disclosed
EP-0611259-A1 Fibre-reactive phthalocyanine dyes SANDOZ LTD. (CH) 1994-08-17 EP disclosed
JP-H06220348-A FIBER-REACTIVE DYE SANDOZ AG 1994-08-09 JP disclosed
US-5227477-A Fiber-reactive SANDOZ LTD. (CH) 1993-07-13 US disclosed
US-5126443-A Color fast fiber-reactive dyes SANDOZ LTD. (CH) 1992-06-30 US disclosed
US-4900812-A Sulfo group-containing metal phlhalocyanine azo compound having a 6-hydroxypyrid-2-one coupling component radicals having a fiber-reactive group SANDOZ LTD. (CH) 1990-02-13 US disclosed