SCHEMBL444548

SCHEMBL444548

C=C(CCC(C)O)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 1/20 0.36
CYP3A4 P08684 1/20 0.34
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
GABRA4 P48169 2/20 0.33
GABRE P78334 2/20 0.33
GABRA6 Q16445 2/20 0.33
GABRG1 Q8N1C3 2/20 0.33
GABRG3 Q99928 2/20 0.33
GABRQ Q9UN88 2/20 0.33
MAPT P10636 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
Dimethylamine SCHEMBL27415329 0.94 ALDH1A1 (0.44) ALDH1A1TDP1CYP3A4GABRPGABRD
SCHEMBL491129 0.85 TDP1 (0.32) ALDH1A1TDP1GABRPGABRDGABRA1
SCHEMBL1773510 0.84 CA1 (0.46) TDP1GABRPGABRDGABRA1GABRB1
SCHEMBL9000251 0.81 TDP1 (0.33) ALDH1A1TDP1ALOX15BLMPMP22
SCHEMBL28433369 0.80 TDP1 (0.35) TDP1GABRPGABRDGABRA1GABRB1
SCHEMBL27792 0.79 ALDH1A1 (0.45) ALDH1A1CYP3A4GABRPGABRDGABRA1
SCHEMBL730425 0.78 CYP1A2 (0.35) TDP1GABRPGABRDGABRA1GABRB1
SCHEMBL17183761 0.78 TDP1 (0.33) TDP1GABRPGABRDGABRA1GABRB1
SCHEMBL732388 0.78 TDP1 (0.33) TDP1GABRPGABRDGABRA1GABRB1
SCHEMBL26199539 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110114439-B Glass composite particles and uses thereof 奈科斯多特股份公司 2023-08-18 CN disclosed
WO-2021191175-A1 DETERGENT FORMULATION IN FORM OF A THREE DIMENSIONAL BODY BASF SE (DE) 2021-09-30 WO disclosed
EP-3555153-B1 MULTI-LAYER FILMS, METHOD FOR ITS MANUFACTURE AND ITS USE BASF SE (DE) 2020-12-09 EP disclosed
EP-3746488-A1 A PROCESS FOR THE PREPARATION OF A POLYMER COMPOSITION BASF SE (DE) 2020-12-09 EP disclosed
US-20200362070-A1 A Process for the Preparation of a Polymer Composition BASF SE (DE) 2020-11-19 US disclosed
WO-2020224962-A1 WATER-SOLUBLE FILMS WITH THREE-DIMENSIONAL TOPOGRAPHY BASF SE (DE) 2020-11-12 WO disclosed
EP-3555182-B1 METHOD FOR PRODUCING FUNCTIONAL WATER SOLUBLE FILMS BASF SE (DE) 2020-10-14 EP disclosed
CN-111615523-A Process for preparing polymer compositions 巴斯夫欧洲公司 2020-09-01 CN disclosed
EP-3016987-B1 POLYMER COMPOSITION, OBTAINED BY POLYMERISATION OF A MONOMER CONTAINING ACID GROUPS IN THE PRESENCE OF A POLYETHER COMPOUND BASF SE (DE) 2020-06-03 EP disclosed
EP-3016986-B1 POLYMER COMPOSITION, OBTAINED BY POLYMERISATION OF A MONOMER CONTAINING ACID GROUPS IN THE PRESENCE OF A POLYETHER COMPOUND BASF SE (DE) 2020-06-03 EP disclosed
WO-2006045508-A1 ANIONIC ETHYL METHACRYLATE COPOLYMERS AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2006-05-04 WO disclosed
WO-2006045510-A1 AMPHOTERIC ETHYL METHACRYLATE COPOLYMERS AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2006-05-04 WO disclosed
WO-2006010571-A1 CROSS-LINKED POLYTETRAHYDROFURAN-CONTAINING POLYURETHANES BASF AKTIENGESELLSCHAFT (DE) 2006-02-02 WO disclosed
WO-2005123014-A1 AQUEOUS PREPARATIONS COMPRISING A WATER-SOLUBLE OR WATER-DISPERSIBLE COPOLYMER WHICH CONTAINS AT LEAST ONE MONOMER HAVING A NITROGEN ATOM BASF AKTIENGESELLSCHAFT (DE) 2005-12-29 WO disclosed
WO-2005058989-A1 COPOLYMERS BASED ON TERT-BUTYL(METH)ACRYLATE AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2005-06-30 WO disclosed
WO-2005058988-A1 AMPHOLYTIC ANIONIC COPOLYMERS BASF AKTIENGESELLSCHAFT (DE) 2005-06-30 WO disclosed
WO-2005004821-A1 COSMETIC AND PHARMACEUTICAL SUBSTANCES BASED ON POLYELECTROLYTE COMPLEXES BASF AKTIENGESELLSCHAFT (DE) 2005-01-20 WO disclosed
EP-0366077-B1 Photopolymerizable resin composition TOKYO OHKA KOGYO CO LTD (JP) 1994-01-26 EP disclosed
US-5236809-A An ethylenically unsaturated compound and a photoinitiator TOKYO OHKA KOGYO CO., LTD. (JP) 1993-08-17 US disclosed
EP-0366077-A2 Photopolymerizable resin composition TOKYO OHKA KOGYO CO., LTD. (JP) 1990-05-02 EP disclosed