SCHEMBL3607067

SCHEMBL3607067

Cc1nc(NC(=N)N)sc1-c1csc(Nc2ccc([N+](=O)[O-])cc2)n1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.73
KMT2A Q03164 7/20 0.73
MAPT P10636 6/20 0.73
ALDH1A1 P00352 5/20 0.73
CYP3A4 P08684 2/20 0.73
CYP2C19 P33261 2/20 0.73
CYP1A2 P05177 1/20 0.73
CYP2D6 P10635 1/20 0.73
CFTR P13569 2/20 0.70
POLB P06746 2/20 0.63
LMNA P02545 2/20 0.63
MCL1 Q07820 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
KDM4E B2RXH2 1/20 0.58
USP2 O75604 1/20 0.58
GAA P10253 1/20 0.58
ALOX15 P16050 1/20 0.58
TSHR P16473 1/20 0.58
HTT P42858 1/20 0.58
GFER P55789 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
SCHEMBL4523033 0.89 MEN1 (0.79) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL25920827 0.85 MEN1 (0.70) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL8226945 0.85 MEN1 (0.65) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL3595812 0.85 MEN1 (0.69) MEN1KMT2AMAPTALDH1A1CFTR
SCHEMBL13125792 0.83 CFTR (1.00) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL3614813 0.83 TRPV4 (0.68) MEN1KMT2AMAPTALDH1A1CFTR
SCHEMBL3608656 0.82 MAPT (0.76) MEN1KMT2AMAPTALDH1A1CFTR
SCHEMBL3603793 0.82 MAPT (0.50) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL3602972 0.81 PIK3CD (0.50) MEN1KMT2AMAPTALDH1A1CYP3A4
SCHEMBL3604078 0.80 PLAU (0.61) MEN1KMT2AMAPTALDH1A1CYP3A4

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
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
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 MEN1 3257/4885KMT2A 4116/4885MAPT 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.