SCHEMBL7144640

SCHEMBL7144640

CC(C)Cc1nnc(N)n(N)c1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.32
MAPT P10636 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
SCHEMBL11713729 0.80 POLB (0.31) ALDH1A1KDM4EPOLBMAPT
SCHEMBL7028443 0.79 KDM4E (0.33) ALDH1A1KDM4EGAAMAPT
Hydrochloric Acid SCHEMBL7031307 0.77 GAA (0.33) ALDH1A1KDM4EGAAMAPT
SCHEMBL7021196 0.73 ALDH1A1 (0.37) ALDH1A1KDM4EMAPT
SCHEMBL7023893 0.71 POLB (0.34) GAAPOLB
SCHEMBL9802011 0.70 NPSR1 (0.30)
Hydrochloric Acid SCHEMBL7029949 0.69 POLB (0.33) GAAPOLB
SCHEMBL7025216 0.69 POLB (0.31) POLB
SCHEMBL7029971 0.67 ALDH1A1 (0.55) ALDH1A1KDM4EGAAPOLBMAPT
Hydrochloric Acid SCHEMBL7021156 0.67 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDHSD17B10POLB

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
EP-0889884-B1 1,2,4-TRIAZINE DERIVATIVES FOR THE INHIBITION OF PROTEIN GLYCOSYLATION ALTEON INC (US) 2003-01-29 EP disclosed
US-6380192-B1 FOR INHIBITING NONENZYMATIC CROSS-LINKING (PROTEIN AGING) ALTEON, INC. 2002-04-30 US disclosed
US-6060470-A Triazine compounds and methods of use therefor ALTEON, INC. 2000-05-09 US disclosed
US-5932578-A CAPABLE OF INHIBITING THE FORMATION OF ADVANCED GLYCOSYLATION ENDPRODUCTS OF TARGET PROTEINS. FOOD SPOILAGE AND ANIMAL PROTEIN AGING CAN BE TREATED. ALTEON INC. (US) 1999-08-03 US disclosed