SCHEMBL21708012

SCHEMBL21708012

CCOC(=O)c1csc(Nc2ccc([N+](=O)[O-])cc2)n1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.66
RAB9A P51151 2/20 0.66
CA12 O43570 10/20 0.57
CA1 P00915 10/20 0.57
CA2 P00918 10/20 0.57
CA9 Q16790 10/20 0.57
AMY1A P0DUB6 3/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
EGFR P00533 1/20 0.53
MEN1 O00255 1/20 0.52
POLB P06746 1/20 0.52
MAPT P10636 1/20 0.52
MAPK1 P28482 1/20 0.52
KMT2A Q03164 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
NPC1 O15118 1/20 0.52

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
SCHEMBL21708021 0.85 MAPT (0.68) GAARAB9ACA12CA1CA2
SCHEMBL21708008 0.84 KDM1A (0.67) GAARAB9ACA12CA1CA2
SCHEMBL5041112 0.83 EGFR (0.73) GAARAB9ACA12CA1CA2
SCHEMBL10464406 0.83 MAPT (0.65) GAARAB9ACA12CA1CA2
SCHEMBL14601432 0.83 RAB9A (0.57) GAARAB9ACYP1A2CYP2C19MEN1
SCHEMBL4789312 0.83 SMN1; SMN2 (0.69) GAARAB9ACA12CA1CA2
SCHEMBL21708010 0.82 GAA (0.64) GAARAB9ACA12CA1CA2
SCHEMBL790315 0.82 MAPT (0.64) GAARAB9ACA12CA1CA2
Bromide SCHEMBL5585456 0.82 MAPT (0.56) GAARAB9ACYP1A2CYP2C19MEN1
SCHEMBL525606 0.82 MAOA (0.64) GAARAB9ACA12CA1CA2

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-20200062719-A1 Application of Imidazopyridine Derivatives in Regenerative Medicine UNIVERSITY OF HEIDELBERG (DE) 2020-02-27 US disclosed
EP-3611256-A1 APPLICATION OF IMIDAZOPYRIDINE DERIVATIVES IN REGENERATIVE MEDICINE Universität Heidelberg (DE) 2020-02-19 EP 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-20200062719-A1 Application of Imidazopyridine Derivatives in Regenerative Medicine DOT1L, NSD1, KDM3A GAA 3974/4885RAB9A 3350/4885CA12 4551/4885

“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.