SCHEMBL13407755

SCHEMBL13407755

CSc1nc2sc3ccccc3c2c(=O)n1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.53
▸ MEN1 O00255 5/20 0.52
▸ KMT2A Q03164 5/20 0.52
▸ ALDH1A1 P00352 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ LMNA P02545 3/20 0.48
▸ MAPT P10636 4/20 0.47
▸ TSHR P16473 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ GAA P10253 1/20 0.44
▸ PDE7A Q13946 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HCAR1 Q9BXC0 1/20 0.42

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
SCHEMBL15113094 0.91 POLB (0.53) POLBMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL15113093 0.89 LMNA (0.44) POLBMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13407756 0.81 MEN1 (0.64) POLBMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13407758 0.81 ALDH1A1 (0.68) POLBMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13407753 0.76 MAPT (0.78) POLBMEN1KMT2AALDH1A1LMNA
SCHEMBL19487245 0.75 LMNA (0.77) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL29832372 0.69 PDE7A (0.69) POLBMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL290649 0.69 PDE7A (0.69) POLBMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL3337074 0.68 PDE7A (0.63) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL15228729 0.68 PDE7A (0.64) POLBMEN1KMT2AALDH1A1SMN1; SMN2

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-20140024662-A1 COMPOUNDS, SCREENS, AND METHODS OF TREATMENT SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY (CN) 2014-01-23 — — US disclosed
US-20100087453-A1 COMPOUNDS, SCREENS, AND METHODS OF TREATMENT PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-04-08 — — 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 (2 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-20140024662-A1 COMPOUNDS, SCREENS, AND METHODS OF TREATMENT ASAH2, LITAF, CYP27A1 POLB 1924/4885MEN1 2053/4885KMT2A 4813/4885
US-20100087453-A1 COMPOUNDS, SCREENS, AND METHODS OF TREATMENT ASAH2, LITAF, CYP27A1 POLB 2006/4885MEN1 2131/4885KMT2A 4822/4885

“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.

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