SCHEMBL7610185

SCHEMBL7610185

CC(=O)NCCN(N)C(=N)N

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
MTNR1A P48039 9/20 0.41
MTNR1B P49286 9/20 0.41
PAOX Q6QHF9 3/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 2/20 0.38
ADRA1A P35348 1/20 0.34
F13A1 P00488 1/20 0.32
NFKB1 P19838 1/20 0.31
KCNH2 Q12809 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
Bromide SCHEMBL7611201 0.98 KDM4E (0.40) KDM4EMAPK1HIF1AMTNR1AMTNR1B
Hydrochloric Acid SCHEMBL3500893 0.98 KDM4E (0.40) KDM4EMAPK1HIF1AMTNR1AMTNR1B
Bromide SCHEMBL7610282 0.96 KDM4E (0.39) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL7613702 0.89 KDM4E (0.48) KDM4EMAPK1HIF1AMTNR1AMTNR1B
Bromide SCHEMBL7613738 0.87 KDM4E (0.47) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL7615499 0.87 HIF1A (0.52) KDM4EMAPK1HIF1AMTNR1AMTNR1B
Hydrochloric Acid SCHEMBL7612933 0.87 KDM4E (0.47) KDM4EMAPK1HIF1AMTNR1AMTNR1B
Bromide SCHEMBL7619298 0.85 HIF1A (0.50) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL9694938 0.72 KDM4E (0.50) KDM4EMAPK1HIF1AMTNR1AMTNR1B
SCHEMBL14366448 0.71 KDM4E (0.44) KDM4EMAPK1HIF1AMTNR1AMTNR1B

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-0888293-B1 N-ACYLAMINOALKYLHYDRAZINECARBOXIMIDAMIDES ALTEON INC (US) 2002-03-27 EP claimed
US-5877217-A INHIBITING THE FORMATION OF ADVANCED GLYCOSYLATION ENDPRODUCTS OF TARGET PROTEINS. INHIBITING THE DISCOLORATION OF TEETH. ALTEON INC. (US) 1999-03-02 US claimed
EP-0888293-A1 N-ACYLAMINOALKYLHYDRAZINECARBOXIMIDAMIDES ALTEON, INC. (US) 1999-01-07 EP claimed
WO-1997023447-A1 N-ACYLAMINOALKYLHYDRAZINECARBOXIMIDAMIDES ALTEON INC. (US) 1997-07-03 WO claimed
EP-0888293-B1 N-ACYLAMINOALKYLHYDRAZINECARBOXIMIDAMIDES ALTEON INC (US) 2002-03-27 EP disclosed
US-5877217-A INHIBITING THE FORMATION OF ADVANCED GLYCOSYLATION ENDPRODUCTS OF TARGET PROTEINS. INHIBITING THE DISCOLORATION OF TEETH. ALTEON INC. (US) 1999-03-02 US disclosed
EP-0888293-A1 N-ACYLAMINOALKYLHYDRAZINECARBOXIMIDAMIDES ALTEON, INC. (US) 1999-01-07 EP disclosed
WO-1997023447-A1 N-ACYLAMINOALKYLHYDRAZINECARBOXIMIDAMIDES ALTEON INC. (US) 1997-07-03 WO disclosed