SCHEMBL3608636

SCHEMBL3608636

CNc1cccc(-c2csc(NC(=N)N)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.51
NPC1 O15118 6/20 0.51
RAB9A P51151 6/20 0.51
GAA P10253 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ABL1 P00519 2/20 0.50
ROCK2 O75116 1/20 0.50
ROCK1 Q13464 1/20 0.50
SMN1; SMN2 Q16637 6/20 0.49
ALDH1A1 P00352 4/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
VCP P55072 1/20 0.48
ALOX5 P09917 1/20 0.48
NFKB1 P19838 2/20 0.47
NFKB2 Q00653 2/20 0.47
RELA Q04206 2/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 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
SCHEMBL11239265 0.91 MAPT (0.57) MAPTNPC1RAB9AGAANPSR1
SCHEMBL11248461 0.87 MAPT (0.55) MAPTNPC1RAB9AGAANPSR1
SCHEMBL11248010 0.87 SIRT5 (0.52) MAPTNPC1RAB9AGAANPSR1
SCHEMBL3612694 0.86 MAPT (0.67) MAPTNPC1RAB9AGAANPSR1
SCHEMBL11246181 0.86 MAPT (0.53) MAPTNPC1RAB9AGAANPSR1
SCHEMBL11246073 0.85 MAPT (0.48) MAPTNPC1RAB9AGAANPSR1
SCHEMBL10675056 0.85 MAPT (0.50) MAPTNPC1RAB9AGAANPSR1
SCHEMBL3606550 0.85 MAPT (0.52) MAPTNPC1RAB9AGAANPSR1
SCHEMBL3604035 0.84 ATP4A (0.56) MAPTNPC1RAB9AGAANPSR1
Bromide SCHEMBL11253435 0.84 MAPT (0.51) MAPTNPC1RAB9AGAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US claimed
CN-101466692-A Thiazol-guanidine derivatives useful as a (beta) - related pathologies ASTRAZENECA AB (SE) 2009-06-24 CN claimed
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US disclosed
CN-101466692-A Thiazol-guanidine derivatives useful as a (beta) - related pathologies ASTRAZENECA AB (SE) 2009-06-24 CN disclosed
EP-2010508-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES AstraZeneca AB (SE) 2009-01-07 EP disclosed
WO-2007120096-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES ASTRAZENECA AB (SE) 2007-10-25 WO disclosed
US-4772622-A 3,5-diamino-1,2,4-oxidiazoles as gastric secretion inhibitors MERCK & CO., INC. (US) 1988-09-20 US disclosed
EP-0089730-B1 GUANIDINO HETEROCYCLICPHENYLAMIDINES, PROCESSES FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE ISTITUTO DE ANGELI S.p.A. (IT) 1987-05-27 EP disclosed
US-4645841-A ANTIULCER AGENTS ISTITUTO DE ANGELI, S.P.A. (IT) 1987-02-24 US disclosed
US-4548944-A ANTIULCER, ANTISECRETORY AGENTS ISTITUTO DE ANGELI S.P.A. (IT) 1985-10-22 US disclosed
EP-0089730-A2 Guanidino heterocyclicphenylamidines, processes for their preparation and their pharmaceutical use ISTITUTO DE ANGELI S.p.A. (IT) 1983-09-28 EP disclosed
EP-0059903-A1 Diaminooxadiazoles, their use as gastric secretion inhibitors, and process for their preparation MERCK & CO. INC. (US) 1982-09-15 EP 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 (1 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-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies GRN, MAPT, GUCY1B1 MAPT 2/4885NPC1 267/4885RAB9A 1024/4885

“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.