SCHEMBL28506497

SCHEMBL28506497

NNC(=O)CCNC(=O)NN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
CTSD P07339 1/20 0.50
KDM5C P41229 1/20 0.50
PHF8 Q9UPP1 1/20 0.50
KDM2A Q9Y2K7 1/20 0.50
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 2/20 0.36
LMNA P02545 2/20 0.36
PRMT1 Q99873 1/20 0.34
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
EPHX1 P07099 3/20 0.33
ECE1 P42892 1/20 0.33
TSHR P16473 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
SCHEMBL9286824 0.83 CTSD (0.50) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL3141758 0.83 KDM4E (0.39) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL1934843 0.82 KDM4E (0.54) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL11429181 0.80 CTSD (0.52) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL15244413 0.80 KDM4E (0.46) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL6278791 0.79
SCHEMBL4531902 0.78 KDM4E (0.44) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL14437942 0.78 KDM4E (0.44) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL19593402 0.78 EPHX1 (0.50) KDM4EALDH1A1PRMT1POLBEPHX1
SCHEMBL7783179 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112236494-A Adhesive composition and surface protective film DIC株式会社 2021-01-15 CN disclosed