SCHEMBL3855347

SCHEMBL3855347

OC(Cc1ccccc1)CN1C=NCC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.44
SLC6A3 Q01959 4/20 0.44
GRIN2D O15399 2/20 0.43
GRIN3B O60391 2/20 0.43
ADRA1D P25100 2/20 0.43
ADRA1A P35348 2/20 0.43
ADRA1B P35368 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2C Q14957 2/20 0.43
GRIN3A Q8TCU5 2/20 0.43
SLC18A3 Q16572 1/20 0.40
TRPA1 O75762 1/20 0.40

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
Hydrochloric Acid SCHEMBL284912 0.98 SLC6A4 (0.43) SLC6A4SLC6A3GRIN2DGRIN3BADRA1D
SCHEMBL9621424 0.74 SLC6A4 (0.68) SLC6A4SLC6A3GRIN2DGRIN3BADRA1D
SCHEMBL3286452 0.74 SIGMAR1 (0.48)
Hydrochloric Acid SCHEMBL17968381 0.73 SIGMAR1 (0.47)
SCHEMBL13736835 0.73 SLC6A3 (0.39) SLC6A4SLC6A3GRIN2DGRIN3BADRA1D
SCHEMBL5778051 0.71 SLC6A3 (0.48) SLC6A3
SCHEMBL6174349 0.71 SLC6A4 (0.60) SLC6A4SLC6A3GRIN2DGRIN3BADRA1D
SCHEMBL5967992 0.70 TSHR (0.59) SLC6A4SLC6A3GRIN2DGRIN3BADRA1D
Hydrochloric Acid SCHEMBL1460277 0.70 GRIN2D (0.43) SLC6A4SLC6A3GRIN2DGRIN3BADRA1D
SCHEMBL725840 0.69

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
EP-1011624-B1 PHOTOPROTECTANT COSMETIC COMPOSITION CONTAINING AN ANIONIC SURFACTANT, COMPOSITIONS FILTERING ULTRAVIOLET RADIATION AND AN AMPHIPHILIC CATIONIC OR DIPOLAR ION COMPOUND AND ITS USE OREAL (FR) 2003-11-12 EP claimed
EP-1011624-A1 PHOTOPROTECTANT COSMETIC COMPOSITION CONTAINING AN ANIONIC SURFACTANT, COMPOSITIONS FILTERING ULTRAVIOLET RADIATION AND AN AMPHIPHILIC CATIONIC OR DIPOLAR ION COMPOUND AND ITS USE L'OREAL (FR) 2000-06-28 EP claimed
WO-2000002529-A1 PHOTOPROTECTANT COSMETIC COMPOSITION CONTAINING AN ANIONIC SURFACTANT, COMPOSITIONS FILTERING ULTRAVIOLET RADIATION AND AN AMPHIPHILIC CATIONIC OR DIPOLAR ION COMPOUND AND ITS USE L'OREAL (FR) 2000-01-20 WO claimed
EP-2916652-B2 USE OF LIQUID POLYMER SUSPENSIONS RHODIA OPERATIONS (FR) 2022-02-23 EP disclosed
EP-3475385-A1 AMORPHOUS DITHIAZINE DISSOLUTION FORMULATION AND METHOD FOR USING THE SAME Clariant International Ltd (CH) 2019-05-01 EP disclosed
WO-2018001604-A1 AMORPHOUS DITHIAZINE DISSOLUTION FORMULATION AND METHOD FOR USING THE SAME CLARIANT INTERNATIONAL LTD (CH) 2018-01-04 WO disclosed
EP-2916652-A1 LIQUID POLYMER SUSPENSIONS Rhodia Operations (FR) 2015-09-16 EP disclosed
WO-2014072429-A1 LIQUID POLYMER SUSPENSIONS RHODIA OPERATIONS (FR) 2014-05-15 WO disclosed
EP-1838823-A4 DERIVATIZED POLYSACCHARIDE POLYMER RHODIA (US) 2009-01-07 EP disclosed
EP-1465584-B1 COMBINED STABLE CATIONIC AND ANIONIC SURFACTANT COMPOSITIONS RHODIA (US) 2008-01-23 EP disclosed
EP-1838823-A2 DERIVATIZED POLYSACCHARIDE POLYMER Rhodia, Inc. (US) 2007-10-03 EP disclosed
WO-2006055877-A2 DERIVATIZED POLYSACCHARIDE POLYMER RHODIA INC. (US) 2006-05-26 WO disclosed
EP-1465584-A1 COMBINED STABLE CATIONIC AND ANIONIC SURFACTANT COMPOSITIONS Rhodia Inc. (US) 2004-10-13 EP disclosed
EP-1011624-B1 PHOTOPROTECTANT COSMETIC COMPOSITION CONTAINING AN ANIONIC SURFACTANT, COMPOSITIONS FILTERING ULTRAVIOLET RADIATION AND AN AMPHIPHILIC CATIONIC OR DIPOLAR ION COMPOUND AND ITS USE OREAL (FR) 2003-11-12 EP disclosed
WO-2003055455-A1 COMBINED STABLE CATIONIC AND ANIONIC SURFACTANT COMPOSITIONS RHODIA INC. (US) 2003-07-10 WO disclosed
EP-1011624-A1 PHOTOPROTECTANT COSMETIC COMPOSITION CONTAINING AN ANIONIC SURFACTANT, COMPOSITIONS FILTERING ULTRAVIOLET RADIATION AND AN AMPHIPHILIC CATIONIC OR DIPOLAR ION COMPOUND AND ITS USE L'OREAL (FR) 2000-06-28 EP disclosed
WO-2000002529-A1 PHOTOPROTECTANT COSMETIC COMPOSITION CONTAINING AN ANIONIC SURFACTANT, COMPOSITIONS FILTERING ULTRAVIOLET RADIATION AND AN AMPHIPHILIC CATIONIC OR DIPOLAR ION COMPOUND AND ITS USE L'OREAL (FR) 2000-01-20 WO disclosed