SCHEMBL3595657

SCHEMBL3595657

COc1ccc(-c2csc(NC(=N)N)n2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.66
RAB9A P51151 9/20 0.64
MAPT P10636 8/20 0.64
MEN1 O00255 8/20 0.64
KMT2A Q03164 8/20 0.64
SMN1; SMN2 Q16637 7/20 0.64
NPC1 O15118 7/20 0.64
GAA P10253 4/20 0.64
GSTO1 P78417 1/20 0.63
VCP P55072 1/20 0.62
LMNA P02545 3/20 0.62
ALDH1A1 P00352 5/20 0.61
NFKB1 P19838 3/20 0.61
NFKB2 Q00653 3/20 0.61
RELA Q04206 3/20 0.61
ALOX5 P09917 3/20 0.61
MCL1 Q07820 1/20 0.61
MAPK1 P28482 4/20 0.61
TP53 P04637 2/20 0.60
ADORA3 P0DMS8 1/20 0.58

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
SCHEMBL4331871 0.88 ADORA3 (0.58) PTGS2RAB9AMAPTMEN1KMT2A
SCHEMBL27431503 0.86 PTGS2 (0.66) PTGS2RAB9AMAPTMEN1KMT2A
SCHEMBL3613302 0.84 ALDH1A1 (0.72) PTGS2RAB9AMAPTMEN1KMT2A
SCHEMBL3601789 0.84 KDM4E (0.60) RAB9AMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL3603727 0.84 GSTO1 (0.60) PTGS2RAB9AMAPTMEN1KMT2A
SCHEMBL2380037 0.84 RAB9A (0.61) PTGS2RAB9AMAPTMEN1KMT2A
SCHEMBL3597000 0.84 MEN1 (0.73) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL10922779 0.83 GSTO1 (0.74) PTGS2RAB9AMAPTMEN1KMT2A
SCHEMBL10814398 0.83 MEN1 (0.83) PTGS2RAB9AMAPTMEN1KMT2A
SCHEMBL3615150 0.83 MEN1 (0.55) RAB9AMAPTMEN1KMT2ASMN1; 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 11 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
EP-2010508-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES AstraZeneca AB (SE) 2009-01-07 EP claimed
WO-2007120096-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES ASTRAZENECA AB (SE) 2007-10-25 WO claimed
CN-111825633-B Method for synthesizing 2-guanidyl thiazole compounds by one-pot method 西华大学 2023-11-17 CN disclosed
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US disclosed
WO-2009146013-A1 MYOSIN LIGHT CHAIN PHOSPHATASE INHIBITORS GEORGETOWN UNIVERSITY (US) 2009-12-03 WO disclosed
WO-2009146013-A1 MYOSIN LIGHT CHAIN PHOSPHATASE INHIBITORS GEORGETOWN UNIVERSITY (US) 2009-12-03 WO 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
EP-1532963-A1 Composition for straightening the hair comprising at least one imine not being an hydroxide L'OREAL (FR) 2005-05-25 EP disclosed
EP-1532960-A1 Hair styling composition containing a non-hydroxide imine L'OREAL (FR) 2005-05-25 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 PTGS2 1834/4885RAB9A 1024/4885MAPT 2/4885

“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.