SCHEMBL1734043

SCHEMBL1734043

CCCCCCCCCCCCCCCCCCCCCCC1=NCCN1CCO

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
TOP2A P11388 1/20 0.35
TOP2B Q02880 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
SPHK1 Q9NYA1 3/20 0.33
LMNA P02545 2/20 0.33
SPHK2 Q9NRA0 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TSHR P16473 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
DRD4 P21917 1/20 0.33
SCD O00767 1/20 0.33
KCNH2 Q12809 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
SCHEMBL217215 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL216893 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL9296147 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL15476247 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL3359696 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL11639090 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL9296207 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL6141492 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL1737855 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1
SCHEMBL181446 1.00 CYP1A2 (0.36) CYP1A2CYP2D6TOP2ATOP2BMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5391368-A Hair styling shampoos REVLON CONSUMER PRODUCTS CORPORATION (US) 1995-02-21 US claimed
EP-2654665-A2 METHOD FOR DEVELOPING A LIQUID COMPOSITION TO BE APPLIED TO THE SKIN AS A FOAM AND A COMPOSITION THAT CAN BE APPLIED TOPICALLY MIKA Pharma Gesellschaft für die Entwicklung und Vermarktung pharmazeutischer Produkte mbH (DE) 2013-10-30 EP disclosed
WO-2012083906-A2 METHOD FOR DEVELOPING A LIQUID COMPOSITION TO BE APPLIED TO THE SKIN AS A FOAM AND A COMPOSITION THAT CAN BE APPLIED TOPICALLY MIKA PHARMA GESELLSCHAFT FÜR DIE ENTWICKLUNG UND VERMARKTUNG PHARMAZEUTISCHER PRODUKTE MBH (DE) 2012-06-28 WO disclosed
EP-1633368-B1 FOAMABLE PHARMACEUTICAL COMPOSITIONS AND METHODS FOR TREATING A DISORDER STIEFEL LABORATORIES (US) 2011-11-16 EP disclosed
WO-2011066182-A3 SOCS3 INHIBITION PROMOTES CNS NEURON REGENERATION CHILDREN'S MEDICAL CENTER CORPORATION (US) 2011-10-27 WO disclosed
US-7829107-B2 Foamable pharmaceutical compositions and methods for treating a disorder STIEFEL LABORATORIES, INC. (US) 2010-11-09 US disclosed
WO-2009149374-A2 MULTI-PART CHEMISTRY SYSTEM REVEAL SCIENCES, LLC (US) 2009-12-10 WO disclosed
WO-2009089496-A2 COLOR-CHANGING CLEANSING COMPOSITONS AND METHODS REVEAL SCIENCES, LLC (US) 2009-07-16 WO disclosed
US-20090176673-A1 COLOR-CHANGING CLEANSING COMPOSITIONS AND METHODS REVEAL SCIENCES, LLC (US) 2009-07-09 US disclosed
EP-1476132-A4 SOAP BAR COMPOSITIONS COMPRISING ALPHA SULFONATED FATTY ACID ALKYL ESTERS AND POLYHYDRIDIC ALCOHOLS AND PROCESS FOR PRODUCING SAME STEPAN CO (US) 2008-11-12 EP disclosed
EP-0960134-A1 IMPROVED EMULSION POLYMERIZATION PROCESS UTILIZING ETHYLENICALLY UNSATURATED AMINE SALTS OF SULFONIC, PHOSPHORIC AND CARBOXYLIC ACIDS STEPAN COMPANY (US) 1999-12-01 EP disclosed
US-5965508-A A SYNERGTIC MIXTURE FOR CLEANSING OR LAUNDRY DETERGENT; MILD TO THE SKIN, IMPROVED SMEAR AND BAR FIRMNESS PROPERTIES, GOOD LATHERING; DISH WASHING PASTES, GELS AND BODY WASHES STEPAN COMPANY (US) 1999-10-12 US disclosed
WO-1999020729-A1 SOAP BAR COMPOSITIONS COMPRISING ALPHA SULFONATED FATTY ACID ALKYL ESTERS AND LONG CHAIN FATTY ACIDS STEPAN COMPANY (US) 1999-04-29 WO disclosed
EP-0904052-A1 CLEANING, CONDITIONING AND STYLING HAIR CARE COMPOSITIONS STEPAN COMPANY (US) 1999-03-31 EP disclosed
WO-1997038673-A9 CLEANING, CONDITIONING AND STYLING HAIR CARE COMPOSITIONS 1998-12-30 WO disclosed
WO-1998032773-A1 IMPROVED EMULSION POLYMERIZATION PROCESS UTILIZING ETHYLENICALLY UNSATURATED AMINE SALTS OF SULFONIC, PHOSPHORIC AND CARBOXYLIC ACIDS STEPAN COMPANY (US) 1998-07-30 WO disclosed
WO-1997038673-A1 CLEANING, CONDITIONING AND STYLING HAIR CARE COMPOSITIONS STEPAN COMPANY (US) 1997-10-23 WO disclosed
EP-0684223-A1 Solvent free quaternization of tertiary amines with dimethylsulfate HOECHST AKTIENGESELLSCHAFT (DE) 1995-11-29 EP disclosed
US-5463094-A Solvent free quaternization of tertiary amines with dimethylsulfate HOECHST CELANESE CORPORATION (US) 1995-10-31 US disclosed
US-5391368-A Hair styling shampoos REVLON CONSUMER PRODUCTS CORPORATION (US) 1995-02-21 US disclosed