SCHEMBL7531232

SCHEMBL7531232

COC(C)CC(NC(C)=O)NC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TRPV1 Q8NER1 1/20 0.35
MTNR1A P48039 8/20 0.33
MTNR1B P49286 8/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
ALOX15 P16050 1/20 0.33
NFKB1 P19838 1/20 0.33
PTGS2 P35354 1/20 0.33
THPO P40225 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ACACB O00763 2/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 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
SCHEMBL7527112 0.81 ALDH1A1 (0.39) ALDH1A1TRPV1MTNR1AMTNR1BKDM4E
SCHEMBL7523967 0.81 ALDH1A1 (0.39) ALDH1A1TRPV1MTNR1AMTNR1BKDM4E
SCHEMBL7531553 0.79 ALDH1A1 (0.38) ALDH1A1TRPV1MTNR1AMTNR1BKDM4E
SCHEMBL24238500 0.71 MTNR1A (0.45) ALDH1A1MTNR1AMTNR1BKDM4EACACB
SCHEMBL177660 0.69
SCHEMBL17486681 0.68 TSHR (0.50) ALDH1A1TRPV1MAPTALOX15BLM
SCHEMBL5478726 0.68 TSHR (0.50) ALDH1A1TRPV1MAPTALOX15BLM
SCHEMBL19546002 0.68 MTNR1A (0.32) ALDH1A1MTNR1AMTNR1BMGAMGAA
SCHEMBL5408799 0.67 PLA2G2C (0.39) ALDH1A1TRPV1MTNR1AMTNR1BKDM4E
SCHEMBL15930167 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0812311-B1 HIGHLY POLYMERIZABLE N-VINYLCARBOXYLIC ACID AMIDE AND PRODUCTION PROCESS THEREOF SHOWA DENKO KK (JP) 2002-03-20 EP disclosed
US-6153708-A HAVING AN N-1,3-BUTADIENYLCARBOXYLIC ACID AMIDE CONTENT OF 30 PPM OR LESS. SHOWA DENKO KABUSHIKI KAISHA (JP) 2000-11-28 US disclosed
US-6143836-A PRODUCING HOMOPOLYMER OR COPOLYMER OF N-VINYLCARBOXYLIC ACID AMIDE BY POLYMERIZING HIGHLY POLYMERIZABLE N-VINYLCARBOXYLIC ACID AMIDE HAVING N-1,3-BUTADIENYLCARBOXYLIC ACID AMIDE CONTENT OF 30 PPM OR LESS; USE AS THICKENER SHOWA DENKO KABUSHIKI KAISHA (JP) 2000-11-07 US disclosed
US-6072084-A THERMAL CRACKING OR CATALYTIC CRACKING OF N-(1-ALKOXYETHYL) CARBOXYLIC ACID AMIDE OR ETHYLIDENEBISCARBOXYLIC ACID AMIDE SHOWA DENKO K.K. (JP) 2000-06-06 US disclosed
US-5892115-A PRETREATMENT BY THERMAL OR CATALYTIC CRACKING OF N-(1-ALKOXYETHYL)CARBOXYLIC AMIDE OR ETHYLIDENEBISCARBOXYLIC ACID AMIDE SHOWA DENKO KABUSHIKI KAISHA (JP) 1999-04-06 US disclosed
US-5789619-A USED AS COAGULANTS, LIQUID ABSORBENTS, THICKENERS SHOWA DENKO KABUSHIKI KAISHA (JP) 1998-08-04 US disclosed
EP-0812311-A1 HIGHLY POLYMERIZABLE N-VINYLCARBOXYLIC ACID AMIDE AND PRODUCTION PROCESS THEREOF SHOWA DENKO KABUSHIKI KAISHA (JP) 1997-12-17 EP disclosed
WO-1997024315-A1 HIGHLY POLYMERIZABLE N-VINYLCARBOXYLIC ACID AMIDE AND PRODUCTION PROCESS THEREOF SHOWA DENKO K.K. (JP) 1997-07-10 WO disclosed