SCHEMBL9320685

SCHEMBL9320685

C=CC(=O)NCCCCCCCCCCCCCCN(C)C.C=CN1CCCC1=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.43
ZDHHC2 Q9UIJ5 1/20 0.43
KDM4E B2RXH2 3/20 0.41
RAD52 P43351 1/20 0.38
TGM2 P21980 7/20 0.37
CYP1A2 P05177 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.33
GFER P55789 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 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
SCHEMBL87329 0.95 RAD52 (0.41) ZDHHC20ZDHHC2KDM4ERAD52TGM2
SCHEMBL9321561 0.87 ZDHHC20 (0.42) ZDHHC20ZDHHC2KDM4ETGM2CYP1A2
SCHEMBL83920 0.81 RAD52 (0.44) KDM4ERAD52CYP1A2ALDH1A1MAPT
SCHEMBL511330 0.79 ZDHHC20 (0.65) ZDHHC20ZDHHC2KDM4ETGM2ALDH1A1
SCHEMBL512105 0.79 ZDHHC20 (0.65) ZDHHC20ZDHHC2KDM4ETGM2ALDH1A1
SCHEMBL5057346 0.79 ZDHHC20 (0.65) ZDHHC20ZDHHC2KDM4ETGM2ALDH1A1
SCHEMBL510455 0.79 ZDHHC20 (0.65) ZDHHC20ZDHHC2KDM4ETGM2ALDH1A1
SCHEMBL8850072 0.79 ZDHHC20 (0.65) ZDHHC20ZDHHC2KDM4ETGM2ALDH1A1
SCHEMBL8850445 0.79 ZDHHC20 (0.65) ZDHHC20ZDHHC2KDM4ETGM2ALDH1A1
SCHEMBL11676767 0.79 ZDHHC20 (0.65) ZDHHC20ZDHHC2KDM4ETGM2ALDH1A1

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 2 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 disclosed
US-4923694-A HAIR CONDITIONERS; (3-METHACRYLAMIDOPROPYL) TRIMETHYL AMMONIUM CHLORIDE-VINYLPYRROLIDONE COPOLYMER GAF CHEMICALS CORPORATION (US) 1990-05-08 US disclosed