SCHEMBL12371971

SCHEMBL12371971

CCOc1ccc(Nc2ccc(C(c3ccc(N(CC)CC)cc3)c3ccc(N(CC)CC)cc3)c3ccccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 4/20 0.42
HTT P42858 4/20 0.42
HPGD P15428 3/20 0.42
MAPT P10636 5/20 0.42
KMT2A Q03164 5/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
POLB P06746 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
KDM1A O60341 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
RAD52 P43351 1/20 0.42
SLC2A1 P11166 1/20 0.41
NOX1 Q9Y5S8 1/20 0.41
MAPK1 P28482 4/20 0.40
LMNA P02545 2/20 0.40
SQSTM1 Q13501 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39

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
SCHEMBL3901015 0.88 KDM1A (0.47) KDM4EALDH1A1HTTHPGDMAPT
SCHEMBL12206075 0.87 KDM1A (0.44) KDM4EALDH1A1HTTHPGDMAPT
SCHEMBL17953189 0.82 KDM1A (0.40) KDM4EALDH1A1HTTHPGDMAPT
SCHEMBL5166274 0.80 CNR2 (0.40) KDM4EALDH1A1HTTHPGDMAPT
SCHEMBL110473 0.78 IDO1 (0.44) ALDH1A1KMT2AKDM1ANOX1RAB9A
Hydrochloric Acid SCHEMBL11238001 0.77 IDO1 (0.43) ALDH1A1KMT2AKDM1ANOX1RAB9A
SCHEMBL11731206 0.76 POLB (0.58) KDM4EALDH1A1HTTMAPTKMT2A
SCHEMBL10526470 0.76 NQO1 (0.50) KDM4EALDH1A1HTTMAPTL3MBTL1
SCHEMBL224751 0.76 KDM1A (0.46) KDM4EALDH1A1HTTHPGDMAPT
SCHEMBL18351144 0.76 CDC25B (0.57) KDM4EALDH1A1HPGDMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003589-B2 Laundry composition THE PROCTER & GAMBLE COMPANY (US) 2011-08-23 US disclosed
US-8003589-B2 Laundry composition THE PROCTER & GAMBLE COMPANY (US) 2011-08-23 US disclosed
EP-1761623-B1 LAUNDRY DETERGENT COMPOSITIONS WITH EFFICIENT HUEING DYE PROCTER & GAMBLE (US) 2010-11-17 EP disclosed
US-20090186797-A1 LAUNDRY COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2009-07-23 US disclosed
US-20090186797-A1 LAUNDRY COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2009-07-23 US disclosed
EP-1975226-A1 Liquid treatment composition The Procter and Gamble Company (US) 2008-10-01 EP disclosed
US-20080229519-A1 Liquid treatment composition PROCTER & GAMBLE COMPANY, THE 2008-09-25 US disclosed
US-20080229519-A1 Liquid treatment composition PROCTER & GAMBLE COMPANY, THE 2008-09-25 US disclosed
WO-2007111887-A2 LAUNDRY COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2007-10-04 WO disclosed
US-7208459-B2 Laundry detergent compositions with efficient hueing dye THE PROCTER & GAMBLE COMPANY (US) 2007-04-24 US disclosed
US-7208459-B2 Laundry detergent compositions with efficient hueing dye THE PROCTER & GAMBLE COMPANY (US) 2007-04-24 US disclosed
US-7205269-B2 Laundry detergent compositions with hueing dye THE PROCTER & GAMBLE COMPANY (US) 2007-04-17 US disclosed
US-7205269-B2 Laundry detergent compositions with hueing dye THE PROCTER & GAMBLE COMPANY (US) 2007-04-17 US disclosed