SCHEMBL4778415

SCHEMBL4778415

CCCC1=NCCc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 1/20 0.55
NOS3 P29474 2/20 0.50
NOS2 P35228 1/20 0.50
GLA P06280 1/20 0.44
RCE1 Q9Y256 1/20 0.44
MAOA P21397 1/20 0.41
CES1 P23141 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
HTR1A P08908 2/20 0.36
SLC22A1 O15245 1/20 0.36
CACNA1F O60840 1/20 0.36
NTRK1 P04629 1/20 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
SCHEMBL27577140 0.90 KDM4E (0.53) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL7759078 0.88 KDM4E (0.51) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL29868676 0.88 KDM4E (0.51) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL29361631 0.87 KDM4E (0.60) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL7509399 0.87 KDM4E (0.60) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL27996594 0.87 MEN1 (0.51) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL4764699 0.87 MEN1 (0.51) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL9095677 0.82 KDM4E (0.55) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL29868935 0.81 KDM4E (0.61) KDM4EALDH1A1NOS3NOS2GLA
SCHEMBL8200669 0.81 KDM4E (0.61) KDM4EALDH1A1NOS3NOS2GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012071153-A1 IMPROVED BLEACHING OF FOOD STAINS THE PROCTER & GAMBLE COMPANY (US) 2012-05-31 WO claimed
EP-2457988-A1 Improved bleaching of food stains The Procter & Gamble Company (US) 2012-05-30 EP claimed
EP-1398367-B1 Cleaning compositions containing multiply-substituted protease variants GENENCOR INT (US) 2008-12-10 EP claimed
EP-4132458-A1 STRUCTURED RHEOLOGICAL SOLID PERSONAL CARE COMPOSITIONS The Procter & Gamble Company (US) 2023-02-15 EP disclosed
US-20170342353-A1 PROCESS FOR WASHING FABRICS THE PROCTER & GAMBLE COMPANY 2017-11-30 US disclosed
WO-2017205265-A1 PROCESS FOR WASHING FABRICS THE PROCTER & GAMBLE COMPANY (US) 2017-11-30 WO disclosed
EP-3249035-A1 PROCESS FOR WASHING FABRICS The Procter and Gamble Company (US) 2017-11-29 EP disclosed
EP-2573158-B1 Bleaching composition for food stains PROCTER & GAMBLE (US) 2016-11-30 EP disclosed
WO-2013043460-A1 BLEACHING COMPOSITION FOR FOOD STAINS THE PROCTER & GAMBLE COMPANY (US) 2013-03-28 WO disclosed
EP-2573158-A1 Bleaching composition for food stains The Procter and Gamble Company (US) 2013-03-27 EP disclosed
US-20130067663-A1 BLEACHING OF FOOD STAINS THE PROCTER & GAMBLE COMPANY (US) 2013-03-21 US disclosed
WO-2012071153-A1 IMPROVED BLEACHING OF FOOD STAINS THE PROCTER & GAMBLE COMPANY (US) 2012-05-31 WO disclosed
US-20120131754-A1 BLEACHING OF FOOD STAINS PROCTER & GAMBLE COMPANY, THE 2012-05-31 US disclosed
EP-2457988-A1 Improved bleaching of food stains The Procter & Gamble Company (US) 2012-05-30 EP disclosed
EP-0861250-B1 AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE ASTRAZENECA AB (SE) 2002-02-13 EP disclosed
US-6140322-A Amidine and isothiourea derivatives as inhibitors of nitric oxide synthase ASTRA AKTIEBOLAG (SE) 2000-10-31 US disclosed
US-5929085-A Amidine and isothiourea derivatives, compositions containing them and their use as inhibitors of nitric oxide synthase ASTRA AKTIEBOLAG (SE) 1999-07-27 US disclosed
EP-0861250-A1 AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE Astra Aktiebolag (SE) 1998-09-02 EP disclosed
WO-1997017344-A1 AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE ASTRA AKTIEBOLAG (SE) 1997-05-15 WO disclosed