SCHEMBL3593422

SCHEMBL3593422

Cc1sc(NC(=N)N)nc1-c1cccc(N)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.47
ALOX5 P09917 1/20 0.47
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
GSTO1 P78417 1/20 0.45
ALDH1A1 P00352 6/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ATP4A P20648 3/20 0.44
ATP4B P51164 3/20 0.44
MAPK1 P28482 1/20 0.43
RAB9A P51151 2/20 0.43
LMNA P02545 2/20 0.43
PKM P14618 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MAOA P21397 4/20 0.42
MAOB P27338 4/20 0.42
MAPT P10636 3/20 0.42

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 SCHEMBL11260405 0.99 XIAP (0.46) XIAPALOX5MEN1KMT2AGSTO1
SCHEMBL3598534 0.87 CFTR (0.50) XIAPALOX5MEN1KMT2AGSTO1
SCHEMBL3598191 0.85 ALOX5 (0.63) XIAPALOX5MEN1KMT2AGSTO1
SCHEMBL3606784 0.84 ALDH1A1 (0.49) MEN1KMT2AALDH1A1HSD17B10CYP1A2
SCHEMBL3596697 0.82 XIAP (0.47) XIAPMEN1KMT2AALDH1A1RAB9A
SCHEMBL3605366 0.81 MEN1 (0.48) XIAPALOX5MEN1KMT2AGSTO1
Hydrochloric Acid SCHEMBL7140582 0.81 XIAP (0.46) XIAPMEN1KMT2AALDH1A1RAB9A
SCHEMBL3601552 0.80 ATP4A (0.61) XIAPALOX5MEN1KMT2AGSTO1
SCHEMBL3597588 0.80 PLTP (0.46) ALDH1A1HSD17B10MAPTHPGDTSHR
SCHEMBL3601806 0.80 ALOX5 (0.49) XIAPALOX5MEN1KMT2AGSTO1

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 XIAP 4640/4885ALOX5 3883/4885MEN1 3257/4885

“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.