SCHEMBL3599516

SCHEMBL3599516

CC(=O)N1CCc2cc(-c3nc(NC(=N)N)sc3C)ccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
SMN1; SMN2 Q16637 7/20 0.57
ALDH1A1 P00352 5/20 0.57
MAPT P10636 4/20 0.57
HTT P42858 4/20 0.57
NPSR1 Q6W5P4 1/20 0.57
USP2 O75604 1/20 0.56
GAA P10253 2/20 0.55
RAB9A P51151 2/20 0.53
NPC1 O15118 1/20 0.53
TSHR P16473 1/20 0.53
GFER P55789 1/20 0.53
HSD17B10 Q99714 1/20 0.53
NT5E P21589 1/20 0.53
LMNA P02545 6/20 0.49
POLB P06746 2/20 0.49
MAFG O15525 1/20 0.49
HPGD P15428 1/20 0.49
NFE2L2 Q16236 1/20 0.49

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
SCHEMBL3602226 0.89 MEN1 (0.62) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL3607915 0.89 SMN1; SMN2 (0.57) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL3615406 0.86 SMN1; SMN2 (0.68) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL3604660 0.83 ALDH1A1 (0.58) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL17549346 0.82 SMN1; SMN2 (0.58) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL31457825 0.82 MAPT (0.75) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL3609848 0.81 RAB9A (0.59) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL17551347 0.77 MEN1 (0.54) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL16085468 0.77 SMN1; SMN2 (0.80) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL16085548 0.77 ALDH1A1 (0.69) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT

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 MEN1 3257/4885KMT2A 4116/4885SMN1; SMN2 96/4885

“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.