SCHEMBL3245508

SCHEMBL3245508

ON([C]=S)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MEN1 O00255 2/20 0.39
HSP90AA1 P07900 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39
FAAH O00519 1/20 0.37
PHGDH O43175 1/20 0.37
MGLL Q99685 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
MIF P14174 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL2962092 0.74 NPSR1 (0.44) ALDH1A1KMT2AL3MBTL1MEN1HSP90AA1
SCHEMBL2858411 0.72 ALDH1A1 (0.39) ALDH1A1KMT2AL3MBTL1MEN1GAA
SCHEMBL3239379 0.69 ALDH1A1 (0.40) ALDH1A1KMT2AL3MBTL1MEN1GAA
SCHEMBL4732140 0.69 NPSR1 (0.44) ALDH1A1KMT2AL3MBTL1MEN1GAA
SCHEMBL3240535 0.68 ALDH1A1 (0.37) ALDH1A1KMT2AL3MBTL1MEN1GAA
SCHEMBL6872355 0.68 CA12 (0.37) ALDH1A1KMT2AL3MBTL1MEN1GAA
SCHEMBL3246061 0.68 ALDH1A1 (0.41) ALDH1A1KMT2AL3MBTL1MEN1GAA
SCHEMBL3252000 0.68 MEN1 (0.42) ALDH1A1KMT2AL3MBTL1MEN1HSP90AA1
SCHEMBL11483104 0.68 ALDH1A1 (0.36) ALDH1A1KMT2AL3MBTL1MEN1GAA
SCHEMBL1032263 0.67 NPSR1 (0.48) ALDH1A1KMT2AL3MBTL1MEN1HSP90AA1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1167366-B1 AMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2010-05-05 EP disclosed
CN-1162427-C Amine derivatives compounds ������������ʽ���� 2004-08-18 CN disclosed
US-6562849-B1 Amine compound or pharmacologically acceptable salt thereof. These compounds are useful in the treatment and/or prophylaxis of diseases such as diabetes, hyperlipemia, arteriosclerosis, cancer, etc. SANKYO COMPANY, LIMITED (JP) 2003-05-13 US disclosed
US-20030078426-A1 Amine derivative compounds SANKYO COMPANY, LIMITED (JP) 2003-04-24 US disclosed
CN-1354750-A Amine derivatives compounds SANKYO CO (JP) 2002-06-19 CN disclosed
EP-1167366-A1 AMINE DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 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-20030078426-A1 Amine derivative compounds H1-10, APOB, PRMT1 ALDH1A1 874/4885KMT2A 85/4885L3MBTL1 457/4885

“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.