SCHEMBL3609839

SCHEMBL3609839

CN(C)Cc1ccccc1-c1csc(NC(=N)N)n1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
ATP4A P20648 5/20 0.44
ATP4B P51164 5/20 0.44
GSTO1 P78417 3/20 0.41
CYP1A2 P05177 5/20 0.41
CYP2D6 P10635 5/20 0.41
ALDH1A1 P00352 2/20 0.41
PLAU P00749 2/20 0.41
HSD17B10 Q99714 1/20 0.41
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
CYP3A4 P08684 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL27747331 0.85 ATP4A (0.47) MAPTATP4AATP4BGSTO1ALDH1A1
SCHEMBL3597985 0.79 ATP4A (0.61) ATP4AATP4BGSTO1PLAULMNA
SCHEMBL26884046 0.79 LMNA (0.57) MAPTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL3607043 0.78 CNR2 (0.44) MAPTATP4AATP4BALDH1A1PLAU
SCHEMBL11239260 0.78 ATP4A (0.47) MAPTATP4AATP4BGSTO1PLAU
SCHEMBL30660073 0.78 GSTO1 (0.64) ATP4AATP4BGSTO1CYP1A2ALDH1A1
SCHEMBL3612827 0.78 ATP4A (0.47) MAPTATP4AATP4BGSTO1PLAU
SCHEMBL3608371 0.78 GSTO1 (0.64) ATP4AATP4BGSTO1CYP1A2ALDH1A1
SCHEMBL3609963 0.78 GSTO1 (0.61) MAPTATP4AATP4BGSTO1
SCHEMBL3610620 0.77 ATP4A (0.49) MAPTATP4AATP4BGSTO1PLAU

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 7 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
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-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

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 2/4885ATP4A 996/4885ATP4B 1107/4885

“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.