SCHEMBL9320179

SCHEMBL9320179

C=CC(=O)NCCC(CC)(CC)N(C)C

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.49
ZDHHC2 Q9UIJ5 1/20 0.49
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GAA P10253 1/20 0.36
TGM2 P21980 2/20 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
SCHEMBL19287489 0.78 ZDHHC20 (0.52) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL28005173 0.76 ZDHHC20 (0.50) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL15577127 0.75 ZDHHC20 (0.49) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Trimethylammonium SCHEMBL21701 0.75 ZDHHC20 (0.62) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL6283366 0.75 ZDHHC20 (0.52) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL10965038 0.74 ZDHHC20 (0.43) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL14635847 0.73 ZDHHC20 (0.47) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Trimethylammonium SCHEMBL2124087 0.73 ZDHHC20 (0.60) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL12731248 0.73 ZDHHC20 (0.50) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Trimethylammonium SCHEMBL269883 0.73 ZDHHC20 (0.60) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0430963-B1 HYDROLYSIS RESISTANT VINYL LACTAM AMINO ACRYLAMIDE POLYMERS ISP INVESTMENTS INC (US) 1994-01-12 EP claimed
EP-0430963-A4 HYDROLYSIS RESISTANT VINYL LACTAM AMINO ACRYLAMIDE POLYMERS 1991-11-21 EP claimed
EP-0430963-A1 HYDROLYSIS RESISTANT VINYL LACTAM AMINO ACRYLAMIDE POLYMERS. GAF CHEMICALS CORP (US) 1991-06-12 EP claimed
WO-1990001920-A1 HYDROLYSIS RESISTANT VINYL LACTAM AMINO ACRYLAMIDE POLYMERS GAF CHEMICALS CORPORATION (US) 1990-03-08 WO claimed
EP-0430963-B1 HYDROLYSIS RESISTANT VINYL LACTAM AMINO ACRYLAMIDE POLYMERS ISP INVESTMENTS INC (US) 1994-01-12 EP disclosed
EP-0430963-A4 HYDROLYSIS RESISTANT VINYL LACTAM AMINO ACRYLAMIDE POLYMERS 1991-11-21 EP disclosed
EP-0430963-A1 HYDROLYSIS RESISTANT VINYL LACTAM AMINO ACRYLAMIDE POLYMERS. GAF CHEMICALS CORP (US) 1991-06-12 EP disclosed
US-4923694-A HAIR CONDITIONERS; (3-METHACRYLAMIDOPROPYL) TRIMETHYL AMMONIUM CHLORIDE-VINYLPYRROLIDONE COPOLYMER GAF CHEMICALS CORPORATION (US) 1990-05-08 US disclosed
WO-1990001920-A1 HYDROLYSIS RESISTANT VINYL LACTAM AMINO ACRYLAMIDE POLYMERS GAF CHEMICALS CORPORATION (US) 1990-03-08 WO disclosed