SCHEMBL1705402

SCHEMBL1705402

CCCC(CCI)CNC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
CHRM1 P11229 1/20 0.35
AKR1A1 P14550 1/20 0.35
CHRM3 P20309 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
ADRA1A P35348 1/20 0.35
HRH1 P35367 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HDAC7 Q8WUI4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
CYP3A4 P08684 1/20 0.30

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
SCHEMBL1964266 0.86 CYP2D6 (0.45) CYP2D6CYP2C19CYP3A4TSHR
SCHEMBL11086397 0.82 CYP2D6 (0.48) CYP2D6CYP2C19CHRM1AKR1A1CHRM3
SCHEMBL27145996 0.74 CYP2D6 (0.36) CYP2D6CYP2C19
SCHEMBL25362832 0.74 CYP2D6 (0.43) CYP2D6CYP2C19
SCHEMBL14481464 0.73 CYP2D6 (0.39) CYP2D6CYP2C19CHRM1AKR1A1CHRM3
SCHEMBL14397158 0.73 PAOX (0.39) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL3274387 0.72 CYP2D6 (0.56) CYP2D6CYP2C19CYP3A4TSHR
SCHEMBL20268376 0.72 CYP2D6 (0.56) CYP2D6CYP2C19CYP3A4TSHR
SCHEMBL3684729 0.71 CYP2D6 (0.50) CYP2D6CYP2C19CHRM1AKR1A1CHRM3
SCHEMBL21766673 0.71 MEN1 (0.44) CHRM1AKR1A1CHRM3HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117355290-A Hair coloring composition for reducing color loss 路博润先进材料公司 2024-01-05 CN disclosed
CN-107108837-B Thermoplastic polyurethane films for delivering active agents to skin surfaces 路博润先进材料公司 2021-04-13 CN disclosed
CN-112218612-A Hair modification compositions and methods 路博润先进材料公司 2021-01-12 CN disclosed
EP-2769707-B1 Water-oil emulsions with multilayer pigment capsules HENKEL AG & CO KGAA (DE) 2017-04-12 EP disclosed
EP-3114933-A1 STAR BLOCK COMB POLYMERS AS BIOACTIVE CARRIER MATRIX FOR THE DRUG ELUTING SEMI-PERMANENT COATING OF SURFACES Henkel AG & Co. KGaA (DE) 2017-01-11 EP disclosed
US-20160251840-A1 DEVICE FOR DISPENSING AN ACTIVE-SUBSTANCE PREPARATION INTO A TOILET BOWL HENKEL AG & CO. KGAA (DE) 2016-09-01 US disclosed
EP-1794292-B1 ALPHA-AMYLASE VARIANTS STABILIZED AGAINST DIMERIZATION AND/OR MULTIMERIZATION, METHOD FOR THE PRODUCTION THEREOF, AND DETERGENTS AND CLEANSERS CONTAINING THESE ALPHA-AMYLASE VARIANTS BASF SE (DE) 2015-12-30 EP disclosed
EP-2769707-A2 Water-oil emulsions with multilayer pigment capsules Henkel AG & Co. KGaA (DE) 2014-08-27 EP disclosed
EP-1463810-B1 Glycosyl hydrolase BRAIN BIOTECHNOLOGY RES & INFORMATION NETWORK AG (DE) 2014-05-14 EP disclosed
WO-2013092080-A1 PERSONAL HYGIENE COMPOSITION WITH IMPROVED SKIN MOISTURE HENKEL AG & CO. KGAA (DE) 2013-06-27 WO disclosed
WO-2001083398-A2 SYSTEM FOR THE RELEASE OF ACTIVE INGREDIENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-11-08 WO disclosed
WO-2001081515-A1 WASHING OR CLEANING AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-11-01 WO disclosed
WO-2001072149-A1 WASHING OF FRUIT AND VEGETABLES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-10-04 WO disclosed
WO-2001062376-A1 MICROCAPSULES AND/OR NANOCAPSULES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-08-30 WO disclosed
WO-2001044433-A1 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS WITH CONTROLLED ACTIVE INGREDIENT RELEASE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-21 WO disclosed
WO-2001044434-A1 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS WITH ENZYME-CONTROLLED ACTIVE INGREDIENT RELEASE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-21 WO disclosed
WO-2001044435-A1 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS WITH CONTROLLED ACTIVE INGREDIENT RELEASE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-21 WO disclosed
WO-2001044421-A2 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS HAVING REDOX-CONTROLLED ACTIVE SUBSTANCE RELEASE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-21 WO disclosed
WO-2001014507-A1 TENSIDE COMPOSITION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-03-01 WO disclosed
WO-2001010996-A1 NON-IONIC SURFACTANT BASED AQUEOUS MULTIPHASE CLEANING AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-02-15 WO disclosed