SCHEMBL574674

SCHEMBL574674

CSc1nn(-c2ccccc2)c(N)c1C#N

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.65
MAPT P10636 9/20 0.51
ALDH1A1 P00352 8/20 0.51
HPGD P15428 6/20 0.51
LMNA P02545 3/20 0.51
GABRP O00591 2/20 0.51
GABRD O14764 2/20 0.51
GABRA1 P14867 2/20 0.51
GABRB1 P18505 2/20 0.51
GABRG2 P18507 2/20 0.51
GABRB3 P28472 2/20 0.51
GABRA5 P31644 2/20 0.51
GABRA3 P34903 2/20 0.51
GABRA2 P47869 2/20 0.51
GABRB2 P47870 2/20 0.51
GABRA4 P48169 2/20 0.51
GABRE P78334 2/20 0.51
GABRA6 Q16445 2/20 0.51
GABRG1 Q8N1C3 2/20 0.51
GABRG3 Q99928 2/20 0.51

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
SCHEMBL8308907 0.84 GAA (0.56) GAAMAPTALDH1A1HPGDLMNA
SCHEMBL6928206 0.82 GABRP (0.65) GAAMAPTGABRPGABRDGABRA1
SCHEMBL2546236 0.81 GAA (0.68) GAAMAPTALDH1A1HPGDLMNA
SCHEMBL11546523 0.79 GAA (0.65) GAAMAPTALDH1A1HPGDLMNA
SCHEMBL13860443 0.79 GAA (1.00) GAAMAPTALDH1A1HPGDLMNA
SCHEMBL12998727 0.78 GABRP (0.48) GAAMAPTALDH1A1HPGDLMNA
SCHEMBL3994806 0.76 GAA (0.61) GAAMAPTALDH1A1HPGDLMNA
SCHEMBL8553062 0.76 GAA (0.61) GAAMAPTALDH1A1HPGDLMNA
SCHEMBL2743087 0.76 GAA (0.61) GAAMAPTALDH1A1HPGDLMNA
SCHEMBL3615656 0.76 GAA (0.61) GAAMAPTALDH1A1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2600897-A2 METHODS AND COMPOSITIONS FOR THE INHIBITION OF FRUCTOKINASE The Regents of the University of Colorado, A Body Corporate (US) 2013-06-12 EP claimed
WO-2012019188-A2 METHODS AND COMPOSITIONS FOR THE INHIBITION OF FRUCTOKINASE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2012-02-09 WO claimed
US-20250177348-A1 Methods for Fructokinase Meditation of Alcohol Craving and Alcohol Induced Liver Disease THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2025-06-05 US disclosed
US-12161621-B2 Methods for fructokinase mediation of alcohol craving and alcohol induced liver disease THE REGENTS OF THE UNIVERSITY OF COLORADO 2024-12-10 US disclosed
US-20210275494-A1 METHODS FOR FRUCTOKINASE MEDIATION OF ALCOHOL CRAVING AND ALCOHOL INDUCED LIVER DISEASE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2021-09-09 US disclosed
WO-2020046481-A2 METHODS FOR FRUCTOKINASE MEDIATION OF ALCOHOL CRAVING AND ALCOHOL INDUCED LIVER DISEASE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2020-03-05 WO disclosed
US-9387245-B2 Methods and compositions for the inhibition of fructokinase UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-07-12 US disclosed
US-9387245-B2 Methods and compositions for the inhibition of fructokinase UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-07-12 US disclosed
US-9387245-B2 Methods and compositions for the inhibition of fructokinase UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-07-12 US disclosed
US-20130224218-A1 Methods and Compositions for the Inhibition of Fructokinase THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY (US) 2013-08-29 US disclosed
US-20130195886-A1 Methods for Fructanase and Fructokinase Inhibition THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2013-08-01 US disclosed
EP-2600897-A2 METHODS AND COMPOSITIONS FOR THE INHIBITION OF FRUCTOKINASE The Regents of the University of Colorado, A Body Corporate (US) 2013-06-12 EP disclosed
WO-2012019188-A2 METHODS AND COMPOSITIONS FOR THE INHIBITION OF FRUCTOKINASE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2012-02-09 WO disclosed
EP-0745684-B1 Method of quantitative determination of peroxides, a peroxidation-active substance or a pyrazolopyridopyridazine derivative KYOWA MEDEX CO LTD (JP) 1999-08-11 EP disclosed
US-5801008-A Method of quantitative determination of peroxide, a peroxidation-active substance or a pyrazolopyridopyridazine derivative KYOWA MEDEX CO., LTD. (JP) 1998-09-01 US disclosed
EP-0745684-A1 Method of quantitative determination of peroxide, a peroxidation-active substance or a pyrazolopyridopyridazine derivative KYOWA MEDEX CO., LTD. (JP) 1996-12-04 EP disclosed
US-4065447-A MONOAZO DYES SANDOZ LTD. (CH) 1977-12-27 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-12161621-B2 Methods for fructokinase mediation of alcohol craving and alcohol induced liver disease KHK, GCK, FN3K GAA 228/4885MAPT 1991/4885ALDH1A1 842/4885
US-20130195886-A1 Methods for Fructanase and Fructokinase Inhibition SI, GCK, FN3K GAA 31/4885MAPT 3170/4885ALDH1A1 1753/4885
US-20210275494-A1 METHODS FOR FRUCTOKINASE MEDIATION OF ALCOHOL CRAVING AND ALCOHOL INDUCED LIVER DISEASE KHK, GCK, FN3K GAA 225/4885MAPT 1978/4885ALDH1A1 784/4885
US-20130224218-A1 Methods and Compositions for the Inhibition of Fructokinase KHK, GCK, HK1 GAA 183/4885MAPT 1830/4885ALDH1A1 1593/4885
US-20250177348-A1 Methods for Fructokinase Meditation of Alcohol Craving and Alcohol Induced Liver Disease KHK, GCK, FN3K GAA 214/4885MAPT 1117/4885ALDH1A1 1191/4885

“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.