SCHEMBL197386

SCHEMBL197386

CN(C)[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
ALOX15 P16050 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
CASR P41180 1/20 0.36
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA4 P43681 1/20 0.34
NOS2 P35228 2/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP1A2 P05177 2/20 0.32
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32

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
SCHEMBL197387 1.00 KMT2A (0.50) KMT2AALOX15BLMPMP22CASR
SCHEMBL23037168 1.00 KMT2A (0.50) KMT2AALOX15BLMPMP22CASR
SCHEMBL19552647 0.86 KMT2A (0.39) KMT2AALOX15BLMPMP22CASR
SCHEMBL6821749 0.85 ALOX15 (0.48) KMT2AALOX15BLMPMP22NOS2
SCHEMBL20099695 0.83 ALOX15 (0.40) KMT2AALOX15BLMPMP22CHRNB2
SCHEMBL198528 0.82 CYP1A2 (0.50) DPP4DPP9CYP1A2GABRPGABRD
SCHEMBL198527 0.82 CYP1A2 (0.50) DPP4DPP9CYP1A2GABRPGABRD
SCHEMBL17772925 0.82 ALOX15 (0.45) KMT2AALOX15BLMPMP22CHRNB2
SCHEMBL17772936 0.82 ALOX15 (0.45) KMT2AALOX15BLMPMP22NOS2
SCHEMBL20516066 0.80 ALOX15 (0.44) KMT2AALOX15BLMPMP22CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109963838-B Dimeric contrast agents 伯拉考成像股份公司 2023-04-11 CN claimed
CN-110612283-B Catalytic process for the preparation of N, N-dimethylglucamine starting from N-methylglucamine 科莱恩国际有限公司 2023-03-14 CN claimed
CN-115152804-A Artemisinin disinfectant with mite and bacterium removing functions and preparation method thereof 烟台三生生物科技有限公司 2022-10-11 CN claimed
EP-4048322-A1 PHARMACEUTICAL COMPOSITIONS OF GD-BASED CONTRAST AGENTS Bracco Imaging SPA (IT) 2022-08-31 EP claimed
CN-108779082-B Contrast agents 伯拉考成像股份公司 2022-08-02 CN claimed
CN-108368067-B Dimeric contrast agents 伯拉考成像股份公司 2022-04-29 CN claimed
CN-110191875-B Catalytic process for the preparation of N, N-dimethylglucamine starting from N-methylglucamine 科莱恩国际有限公司 2022-03-29 CN claimed
CN-108290849-B Contrast agents 伯拉考成像股份公司 2022-03-22 CN claimed
CN-114196251-A Anti-settling stabilizer, preparation method thereof, inorganic coating with storage stability and preparation method thereof 四川瑞珂新材料科技有限公司 2022-03-18 CN claimed
WO-2021078726-A1 PHARMACEUTICAL COMPOSITIONS OF GD-BASED CONTRAST AGENTS BRACCO IMAGING SPA (IT) 2021-04-29 WO claimed
EP-3601210-A1 CATALYTIC PROCESS FOR PREPARING N,N-DIMETHYLGLUCAMINE FROM N-METHYLGLUCAMINE Clariant International Ltd (CH) 2020-02-05 EP claimed
WO-2019243408-A1 PRESERVATIVE-FREE PIGMENT PASTE BRILLUX GMBH & CO. KG (DE) 2019-12-26 WO claimed
WO-2019243407-A1 DISPERSION PAINT BRILLUX GMBH & CO. KG (DE) 2019-12-26 WO claimed
CN-110612283-A Catalytic process for the preparation of N, N-dimethylglucamine starting from N-methylglucamine 科莱恩国际有限公司 2019-12-24 CN claimed
WO-2008077194-A1 RECEPTOR AGONISTS XENOME LTD (AU) 2008-07-03 WO claimed
EP-0822180-B1 Chelating compounds, their chelates with paramagnetic metal ions, their preparation and use BRACCO SPA (IT) 2000-10-25 EP claimed
WO-2000009169-A1 NON-PORPHYRIN COMPOUND FOR USE AS A DIAGNOSTICUM AND/OR PHARMACEUTICAL K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2000-02-24 WO claimed
EP-0506207-B1 Pharmaceutical vehicles for reducing transdermal flux ACCESS PHARMA INC (US) 1999-11-17 EP claimed
US-4957939-A AMINOCARBOXYLIC ACIDS, MEDICAL IMAGING SCHERING AKTIENGESELLSCHAFT (DE) 1990-09-18 US claimed
EP-0184550-A2 5-Amino-4-hydroxy valeryl amide derivatives CIBA-GEIGY AG (CH) 1986-06-11 EP claimed