SCHEMBL3605029

SCHEMBL3605029

Cc1ccc(Oc2ccccc2-c2csc(NC(=N)N)n2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 4/20 0.45
ATP4B P51164 4/20 0.45
VCP P55072 1/20 0.43
PLAU P00749 5/20 0.41
HPGDS O60760 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 3/20 0.40
ATM Q13315 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
CCR6 P51684 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL3607326 0.90 MAPT (0.47) ATP4AATP4BVCPPLAUMEN1
SCHEMBL3602268 0.81 MAPT (0.56) ATP4AATP4BPLAUMEN1KMT2A
SCHEMBL2380032 0.81 ATP4A (0.50) ATP4AATP4BVCPPLAUHPGDS
SCHEMBL3600274 0.81 VCP (0.64) ATP4AATP4BVCPHPGDSMEN1
SCHEMBL3597985 0.79 ATP4A (0.61) ATP4AATP4BPLAU
SCHEMBL3599051 0.76 SMN1; SMN2 (0.46) ATP4AATP4BPLAUMEN1KMT2A
Abafungin SCHEMBL29517947 0.73 MEN1 (0.42) VCPHPGDSMEN1KMT2AMAPT
Abafungin SCHEMBL301669 0.73 MEN1 (0.42) VCPHPGDSMEN1KMT2AMAPT
Abafungin SCHEMBL10455902 0.73 MEN1 (0.41) VCPHPGDSMEN1KMT2AMAPT
SCHEMBL3612827 0.72 ATP4A (0.47) ATP4AATP4BVCPPLAUMEN1

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 ATP4A 996/4885ATP4B 1107/4885VCP 1390/4885

“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.