SCHEMBL2949066

SCHEMBL2949066

CC(=O)Nc1ccc(C=NNC(=N)N)cc1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.59
NOX1 Q9Y5S8 1/20 0.58
ESRRG P62508 1/20 0.58
NPC1 O15118 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MAPT P10636 3/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
LMNA P02545 3/20 0.55
ALDH1A1 P00352 3/20 0.49
GAA P10253 2/20 0.49
DDX3X O00571 1/20 0.49
HPGD P15428 2/20 0.48
KDM4E B2RXH2 3/20 0.48
GLA P06280 1/20 0.47
GFER P55789 1/20 0.47

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
Hydrochloric Acid SCHEMBL9577859 0.98 RAB9A (0.58) RAB9ANOX1ESRRGNPC1SMN1; SMN2
SCHEMBL13985372 0.88 RAB9A (0.52) RAB9ANOX1ESRRGNPC1SMN1; SMN2
SCHEMBL19449695 0.88 RAB9A (0.62) RAB9ANOX1ESRRGNPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL17560925 0.86 RAB9A (0.60) RAB9ANOX1ESRRGNPC1SMN1; SMN2
SCHEMBL13985289 0.85 MGLL (0.49) RAB9ANOX1ESRRGNPC1SMN1; SMN2
Amithiozone SCHEMBL42515 0.85 RAB9A (0.67) RAB9ANOX1ESRRGNPC1SMN1; SMN2
Amithiozone SCHEMBL42516 0.85 RAB9A (0.67) RAB9ANOX1ESRRGNPC1SMN1; SMN2
Amithiozone SCHEMBL23045174 0.84 RAB9A (0.65) RAB9ANOX1ESRRGNPC1SMN1; SMN2
Amithiozone SCHEMBL11223036 0.84 RAB9A (0.65) RAB9ANOX1ESRRGNPC1SMN1; SMN2
Amithiozone SCHEMBL10964163 0.84 RAB9A (0.65) RAB9ANOX1ESRRGNPC1SMN1; SMN2

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1576093-A4 3-DEOXYGLUCOSONE AND SKIN DYNAMIS THERAPEUTICS INC (US) 2009-07-08 EP claimed
US-20070065443-A1 Fructoseamine 3 kinase and the formation of collagen and elastin DYNAMIS THERAPEUTICS, INC. 2007-03-22 US claimed
EP-1753861-A2 FRUCTOSEAMINE 3 KINASE AND THE FORMATION OF COLLAGEN AND ELASTIN Dynamis Therapeutics, Inc. (US) 2007-02-21 EP claimed
EP-1576093-A2 3-DEOXYGLUCOSONE AND SKIN Dynamis Therapeutics, Inc. (US) 2005-09-21 EP claimed
WO-2005079463-A2 FRUCTOSEAMINE 3 KINASE AND THE FORMATION OF COLLAGEN AND ELASTIN DYNAMIS THERAPEUTICS, INC. (US) 2005-09-01 WO claimed
US-20050159383-A1 Administering enzyme inhibitors; wrinkling and aging resistance; prevents formation Advanced Glycation End Products (AGEs) DYNAMIS THERAPEUTICS, INC. 2005-07-21 US claimed
US-20030219440-A1 3-deoxyglucosone and skin DYNAMIS THERAPEUTICS, INC. 2003-11-27 US claimed
WO-2003089601-A2 3-DEOXYGLUCOSONE AND SKIN DYNAMIS THERAPEUTICS, INC. (US) 2003-10-30 WO claimed
US-20100310482-A1 3-Deoxyglucosone And Skin DYNAMIS THERAPEUTICS, INC. (US) 2010-12-09 US disclosed
US-7749503-B2 3-deoxyglucosone and skin DYNAMIS THERAPEUTICS, INC. (US) 2010-07-06 US disclosed
US-7671019-B2 Administering enzyme inhibitors; wrinkling and aging resistance; prevents formation Advanced Glycation End Products (AGEs) DYNAMIS THERAPEUTICS, INC. (US) 2010-03-02 US disclosed
US-7622117-B2 3-deoxyglucosone and skin DYNAMIS THERAPEUTICS, INC. (US) 2009-11-24 US disclosed
EP-1576093-A4 3-DEOXYGLUCOSONE AND SKIN DYNAMIS THERAPEUTICS INC (US) 2009-07-08 EP disclosed
US-20080292568-A1 3-Deoxyglucosone and skin DYNAMIS THERAPEUTICS, INC. (US) 2008-11-27 US disclosed
EP-1175155-A1 METHOD FOR REDUCING A SUSCEPTIBILITY TO TUMOR FORMATION INDUCED BY 3-DEOXYGLUCOSONE AND PRECURSORS THEREOF FOX CHASE CANCER CENTER (US) 2002-01-30 EP disclosed
WO-2000062626-A1 METHOD FOR REDUCING A SUSCEPTIBILITY TO TUMOR FORMATION INDUCED BY 3-DEOXYGLUCOSONE AND PRECURSORS THEREOF FOX CHASE CANCER CENTER (US) 2000-10-26 WO disclosed
US-5272165-A 2-alkylidene-aminoguanidines and methods of use therefor THE ROCKEFELLER UNIVERSITY (US) 1993-12-21 US disclosed
US-5243071-A Acetoacetic acid guanyl hydrazone; inhibits food spoilage and protein aging THE ROCKEFELLER UNIVERSITY (US) 1993-09-07 US disclosed
WO-1992019236-A1 2-ALKYLIDENE-AMINOGUANIDINES FOR INHIBITING ADVANCED NONENZYMATICGLYCOSYLATION OF PROTEINS THE ROCKEFELLER UNIVERSITY (US) 1992-11-12 WO disclosed
US-5130324-A For inhibiting nonezymatic crosslinking of glycosylation products of proteins THE ROCKEFELLER UNIVERSITY (US) 1992-07-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070065443-A1 Fructoseamine 3 kinase and the formation of collagen and elastin FN3K, PDXK, COLGALT1 RAB9A 3851/4885NOX1 969/4885ESRRG 2146/4885
US-20100310482-A1 3-Deoxyglucosone And Skin DPM1, G6PD, UGGT1 RAB9A 3894/4885NOX1 1461/4885ESRRG 3352/4885
US-20080292568-A1 3-Deoxyglucosone and skin DPM1, G6PD, UGGT1 RAB9A 3894/4885NOX1 1461/4885ESRRG 3352/4885
US-20030219440-A1 3-deoxyglucosone and skin DPM1, G6PD, UGGT1 RAB9A 3894/4885NOX1 1461/4885ESRRG 3352/4885
US-20050159383-A1 Administering enzyme inhibitors; wrinkling and aging resistance; prevents formation Advanced Glycation End Products (AGEs) AGER, GLA, GALE RAB9A 1555/4885NOX1 90/4885ESRRG 609/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.