SCHEMBL3605679

SCHEMBL3605679

N=C(N)Nc1nc(-c2csc(CN)n2)cs1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 11/20 0.38
ATP4B P51164 11/20 0.38
AOC3 Q16853 2/20 0.36
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
ELOVL1 Q9BW60 1/20 0.34
KDM4A O75164 1/20 0.34
KDM4B O94953 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
RAB9A P51151 1/20 0.34
TP53 P04637 1/20 0.34
EBP Q15125 1/20 0.34

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
SCHEMBL3602731 0.88 LOXL2 (0.48) ATP4AATP4BAOC3KDM4ENPC1
SCHEMBL3607043 0.82 CNR2 (0.44) ATP4AATP4BAOC3KDM4ENPC1
SCHEMBL3613289 0.82 ABL1 (0.39) ATP4AATP4BAOC3KDM4ENPC1
SCHEMBL3602480 0.80 KDM4E (0.36) ATP4AATP4BKDM4ENPC1MAPK1
SCHEMBL3612796 0.80 PLAU (0.42) ATP4AATP4BKDM4ENPC1HSD17B10
SCHEMBL3607652 0.79 KDM4E (0.44) AOC3KDM4ENPC1MAPK1HSD17B10
Bromide SCHEMBL10854264 0.79 PLAU (0.41) ATP4AATP4BKDM4ENPC1HSD17B10
SCHEMBL3603808 0.79 NPC1 (0.46) KDM4ENPC1MAPK1HSD17B10MEN1
SCHEMBL27768308 0.78 AOC3 (0.50) ATP4AATP4BAOC3KDM4ENPC1
SCHEMBL3601750 0.77 PIK3CG (0.46) AOC3KDM4ENPC1MAPK1HSD17B10

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
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
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US 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

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 ATP4A 996/4885ATP4B 1107/4885AOC3 2043/4885

“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.