SCHEMBL7029641

SCHEMBL7029641

CCCCCCCC(C(=O)OCC)C(=O)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.43
FAAH O00519 3/20 0.42
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GPR84 Q9NQS5 5/20 0.40
FFAR1 O14842 1/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CPB2 Q96IY4 1/20 0.39
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
CA2 P00918 1/20 0.38

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
SCHEMBL8409948 0.93 TDP1 (0.42) FAAHTDP1MEN1KMT2AMAPT
SCHEMBL10017368 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84
SCHEMBL7508355 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84
SCHEMBL5860379 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84
SCHEMBL6828633 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84
SCHEMBL182928 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84
SCHEMBL4416096 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84
SCHEMBL9116048 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84
SCHEMBL2948251 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84
SCHEMBL5849644 0.87 TDP1 (0.50) ZDHHC7TDP1MEN1KMT2AGPR84

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 6 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
EP-0889884-A1 1,2,4-TRIAZINE DERIVATIVES FOR THE INHIBITION OF PROTEIN GLYCOSYLATION ALTEON, INC. (US) 1999-01-13 EP disclosed
WO-1997035849-A1 1,2,4-TRIAZINE DERIVATIVES FOR THE INHIBITION OF PROTEIN GLYCOSYLATION ALTEON INC. (US) 1997-10-02 WO disclosed