SCHEMBL3611053

SCHEMBL3611053

NC(=S)Nc1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.61
LTA4H P09960 6/20 0.55
PTGS1 P23219 1/20 0.55
PTGS2 P35354 1/20 0.55
PSMB1 P20618 7/20 0.55
PSMB5 P28074 7/20 0.55
PSMB2 P49721 5/20 0.54
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL3589376 0.86 HRH3 (0.68) HRH3LTA4HPSMB1PSMB5PSMB2
SCHEMBL13883476 0.86 HRH3 (0.61) HRH3LTA4HPTGS1PTGS2PSMB1
SCHEMBL4167205 0.78 PSMB1 (0.60) HRH3LTA4HPSMB1PSMB5PSMB2
SCHEMBL19145673 0.78 LTA4H (0.59) HRH3LTA4HPTGS1PTGS2PSMB1
SCHEMBL7353075 0.77 PSMB1 (0.66) HRH3LTA4HPTGS2PSMB1PSMB5
SCHEMBL6711583 0.77 ALDH1A1 (0.61) LTA4H
SCHEMBL23742244 0.76 PSMB1 (0.69) HRH3LTA4HPSMB1PSMB5PSMB2
SCHEMBL15492001 0.75 HRH3 (0.66) HRH3PSMB1PSMB5PSMB2
SCHEMBL13467642 0.75 LTA4H (0.60) HRH3LTA4HPSMB1PSMB5
SCHEMBL2475993 0.75 ESR1 (0.75) HRH3LTA4HPTGS1PTGS2PSMB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1687285-B1 THIAZOLE AND PYRAZOLE DERIVATIVES AS FLT-3 KINASE INHIBITORS NOVARTIS AG (CH) 2014-03-05 EP disclosed
EP-1687285-B1 THIAZOLE AND PYRAZOLE DERIVATIVES AS FLT-3 KINASE INHIBITORS NOVARTIS AG (CH) 2014-03-05 EP disclosed
US-7795288-B2 Thiazole and pyrazole derivatives as Flt-3 kinase inhibitors NOVARTIS AG (CH) 2010-09-14 US disclosed
US-7795288-B2 Thiazole and pyrazole derivatives as Flt-3 kinase inhibitors NOVARTIS AG (CH) 2010-09-14 US disclosed
US-7795288-B2 Thiazole and pyrazole derivatives as Flt-3 kinase inhibitors NOVARTIS AG (CH) 2010-09-14 US disclosed
US-20070167449-A1 Thiazole and pyrazole derivatives as flt-3 kinase inhibitors NOVARTIS PHARMA AG (CH) 2007-07-19 US disclosed
US-20070167449-A1 Thiazole and pyrazole derivatives as flt-3 kinase inhibitors NOVARTIS PHARMA AG (CH) 2007-07-19 US disclosed
US-20070167449-A1 Thiazole and pyrazole derivatives as flt-3 kinase inhibitors NOVARTIS PHARMA AG (CH) 2007-07-19 US disclosed
EP-1687285-A1 THIAZOLE AND PYRAZOLE DERIVATIVES AS FLT-3 KINASE INHIBITORS Novartis AG (CH) 2006-08-09 EP disclosed
WO-2005047273-A1 THIAZOLE AND PYRAZOLE DERIVATIVES AS FLT-3 KINASE INHIBITORS NOVARTIS AG (CH) 2005-05-26 WO 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-20070167449-A1 Thiazole and pyrazole derivatives as flt-3 kinase inhibitors FLT3, FLT1, FLT4 HRH3 1666/4885LTA4H 4512/4885PTGS1 2752/4885

“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.