SCHEMBL3608212

SCHEMBL3608212

CC(=O)NCc1nnc(-c2csc(NC(=N)N)n2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.39
ABL1 P00519 6/20 0.39
KDM4E B2RXH2 3/20 0.39
HSD17B10 Q99714 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 2/20 0.38
NPC1 O15118 2/20 0.38
ROCK1 Q13464 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
ALOX15 P16050 1/20 0.37
PIK3CG P48736 1/20 0.37
TYR P14679 1/20 0.37
RAB9A P51151 1/20 0.36
PI4KB Q9UBF8 1/20 0.36

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
SCHEMBL3607652 0.81 KDM4E (0.44) AOC3ABL1KDM4EHSD17B10MEN1
SCHEMBL3612358 0.78 AOC3 (0.57) AOC3ABL1MEN1KMT2AALDH1A1
SCHEMBL3609783 0.77 KDM4E (0.40) AOC3ABL1KDM4EHSD17B10MEN1
SCHEMBL3607773 0.77 KMT2A (0.68) AOC3ABL1KDM4EHSD17B10MEN1
SCHEMBL3602568 0.77 ABL1 (0.56) AOC3ABL1KDM4EHSD17B10MEN1
SCHEMBL3602005 0.76 KMT2A (0.43) AOC3ABL1KDM4EHSD17B10MEN1
SCHEMBL3606627 0.75 KDM4E (0.45) AOC3ABL1KDM4EHSD17B10MEN1
SCHEMBL3607745 0.74 ROCK2 (0.56) ABL1KDM4EHSD17B10ALDH1A1MAPT
SCHEMBL3601750 0.74 PIK3CG (0.46) AOC3ABL1KDM4EHSD17B10MEN1
SCHEMBL3605171 0.73 ABL1 (0.60) AOC3ABL1KDM4EHSD17B10MEN1

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 2 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
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US 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 AOC3 2043/4885ABL1 4507/4885KDM4E 4351/4885

“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.