SCHEMBL9259256

SCHEMBL9259256

C=C(C)C(=O)NC.C=C(C)C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.63
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
TGFBR1 P36897 1/20 0.34
KDM4E B2RXH2 1/20 0.33
CRBN Q96SW2 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
NQO1 P15559 1/20 0.31

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
SCHEMBL15326 0.89
Hydrochloric Acid SCHEMBL28666050 0.86
Dimethylamine SCHEMBL2828540 0.86 ALDH1A1 (0.41) TDP1ALDH1A1LMNATGFBR1KDM4E
Hydrogen Sulfide SCHEMBL27988755 0.86
Ethylene SCHEMBL9814620 0.86 ALDH1A1 (0.41) TDP1ALDH1A1LMNATGFBR1KDM4E
Water SCHEMBL28018314 0.86
Ethylene SCHEMBL9763843 0.86
SCHEMBL1071537 0.83 TDP1 (0.71) TDP1ALDH1A1LMNAALOX15BLM
Acrylamide SCHEMBL9413119 0.83 ALDH1A1 (0.50) TDP1ALDH1A1LMNAALOX15BLM
Dimethylamine SCHEMBL28199343 0.83 TDP1 (0.80) TDP1ALDH1A1LMNAALOX15BLM

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4004125-B1 MIXING SYSTEM FOR PREPARING LOW VOC AQUEOUS COATING AGENTS BASF COATINGS GMBH (DE) 2023-09-06 EP disclosed
WO-2019078181-A1 ETHYLENE-VINYL ALCOHOL COPOLYMER PARTICLES, METHOD FOR PRODUCING SAME AND USE OF SAME 株式会社クラレ 2019-04-25 WO disclosed
EP-0384235-B1 Aqueous dispersions of synthetic resins BASF AG (DE) 1995-05-10 EP disclosed
EP-0384235-A2 Aqueous dispersions of synthetic resins BASF Aktiengesellschaft (DE) 1990-08-29 EP disclosed
US-4557977-A FLUOROCARBON RESIN, ACRYLIC RESIN, AND FLOW MODIFIERS SCM CORPORATION (US) 1985-12-10 US disclosed