SCHEMBL3944157

SCHEMBL3944157

NCC(=O)NN.NCC(=O)NN

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
CTSD P07339 1/20 0.48
KDM5C P41229 1/20 0.48
PHF8 Q9UPP1 1/20 0.48
KDM2A Q9Y2K7 1/20 0.48
LMNA P02545 3/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP1A2 P05177 2/20 0.41
GLRA1 P23415 1/20 0.41
SLC6A9 P48067 1/20 0.41
OR51E2 Q9H255 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
THPO P40225 1/20 0.41
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPT P10636 1/20 0.36

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
SCHEMBL961467 1.00
Hydrochloric Acid SCHEMBL27673433 0.97
SCHEMBL7553031 0.80 MEN1 (0.42) KDM4ECTSDKDM5CPHF8KDM2A
Bromide SCHEMBL11107282 0.78 MEN1 (0.41) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL220535 0.77
SCHEMBL220310 0.74 KDM4E (0.77) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL460908 0.74
SCHEMBL15131270 0.74 GLRA1 (0.44) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL26384671 0.74 KDM4E (0.56) KDM4ECTSDKDM5CPHF8KDM2A
SCHEMBL4105582 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009023357-A2 CURCUMIN DERIVATIVES AND THEIR USE AS RADIOPROTECTORS UNIVERSITY OF ROCHESTER (US) 2009-02-19 WO claimed
WO-2009017874-A9 NOVEL CURCUMIN DERIVATIVES AND THEIR PHARMACEUTICAL USES THEREOF UNIV ROCHESTER (US) 2009-03-19 WO disclosed
WO-2009023357-A2 CURCUMIN DERIVATIVES AND THEIR USE AS RADIOPROTECTORS UNIVERSITY OF ROCHESTER (US) 2009-02-19 WO disclosed
WO-2009017874-A2 NOVEL CURCUMIN DERIVATIVES AND THEIR PHARMACEUTICAL USES THEREOF UNIVERSITY OF ROCHESTER (US) 2009-02-05 WO disclosed