SCHEMBL8229093

SCHEMBL8229093

CCOC(=O)c1csc(NC(=N)NC(=O)OC(C)(C)C)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
CYP2C19 P33261 1/20 0.59
SMN1; SMN2 Q16637 7/20 0.54
RAB9A P51151 5/20 0.54
NPC1 O15118 4/20 0.54
ABCB1 P08183 1/20 0.53
TDP1 Q9NUW8 1/20 0.52
GAA P10253 2/20 0.51
HSP90AA1 P07900 2/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
LMNA P02545 3/20 0.49
KDM4E B2RXH2 3/20 0.49
HPGD P15428 2/20 0.49
ALDH1A1 P00352 2/20 0.49
TSHR P16473 1/20 0.49
EGFR P00533 1/20 0.49
NPSR1 Q6W5P4 1/20 0.48
HSD17B10 Q99714 1/20 0.48
POLB P06746 1/20 0.48

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
Bromide SCHEMBL3599553 0.99 CYP1A2 (0.58) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
SCHEMBL465734 0.88 CYP1A2 (0.67) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
SCHEMBL3601769 0.84 L3MBTL1 (0.54) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
SCHEMBL3931386 0.84 SMN1; SMN2 (0.62) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
SCHEMBL4636472 0.84 SMN1; SMN2 (0.62) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
SCHEMBL2199922 0.83 CYP1A2 (0.60) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
SCHEMBL21911454 0.79 CYP1A2 (0.49) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
SCHEMBL4093041 0.78 CYP1A2 (0.71) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
SCHEMBL13879748 0.78 SMN1; SMN2 (0.54) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1
Bromide SCHEMBL7142285 0.77 CYP1A2 (0.69) CYP1A2CYP2C19SMN1; SMN2RAB9ANPC1

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 3 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 disclosed
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US 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 CYP1A2 3908/4885CYP2C19 4589/4885SMN1; 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.