SCHEMBL4863751

SCHEMBL4863751

COC(=O)c1nc(NC(C)=O)sc1-c1ccc(SC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.53
ALDH1A1 P00352 4/20 0.53
MAPT P10636 2/20 0.53
GAA P10253 2/20 0.53
LMNA P02545 1/20 0.53
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
PIK3CG P48736 6/20 0.48
PIK3CA P42336 5/20 0.48
PIK3CB P42338 5/20 0.48
PIK3CD O00329 4/20 0.48
L3MBTL1 Q9Y468 3/20 0.47
NPC1 O15118 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PKM P14618 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ADORA3 P0DMS8 3/20 0.44
UBE2N P61088 1/20 0.44

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
SCHEMBL4870668 0.84 GAA (0.65) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL4870977 0.81 KDM4E (0.71) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL19762720 0.79 L3MBTL1 (0.48) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL4870776 0.79 PIK3CG (0.49) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL4870860 0.78 PIK3CA (0.45) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL4870851 0.78 PIK3CA (0.45) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL14705871 0.71 PIK3CG (0.52) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL7143965 0.71 KDM4E (0.64) KDM4EALDH1A1MAPTGAAMEN1
SCHEMBL4866085 0.71 CSNK2A2 (0.48) KDM4EALDH1A1MAPTGAALMNA
SCHEMBL4866081 0.71 CSNK2A2 (0.48) KDM4EALDH1A1MAPTGAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608365-B1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE R TECH UENO LTD (JP) 2013-10-02 EP disclosed
CN-1794988-B Composition for treating vascular hyperpermeable disease SUCAMPO AG 2010-07-28 CN disclosed
US-7442715-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2008-10-28 US disclosed
US-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2008-05-22 US disclosed
US-20060276521-A1 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-12-07 US disclosed
US-7125901-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-10-24 US disclosed
US-20060229346-A1 Method for treating vascular hyperpermeable disease SUCAMPO AG (CH) 2006-10-12 US disclosed
CN-1794988-A Method for treating vascular hyperpermeable disease SUCAMPO AG (CH) 2006-06-28 CN disclosed
US-20060128770-A1 Thiazole derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2006-06-15 US disclosed
EP-1608365-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE Sucampo AG (CH) 2005-12-28 EP disclosed
EP-1587800-A1 THIAZOLE DERIVATIVES AND THEIR USE AS VAP-1 INHIBITORS Astellas Pharma Inc. (JP) 2005-10-26 EP disclosed
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-12-23 US disclosed
WO-2004087138-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2004-10-14 WO disclosed
WO-2004067521-A1 THIAZOLE DERIVATIVES AND THEIR USE AS VAP-1 INHIBITORS ASTELLAS PHARMA INC. (JP) 2004-08-12 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 (5 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-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE VCAM1, ICAM1, VAPB KDM4E 3439/4885ALDH1A1 927/4885MAPT 430/4885
US-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 KDM4E 3386/4885ALDH1A1 930/4885MAPT 320/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 KDM4E 2818/4885ALDH1A1 260/4885MAPT 670/4885
US-20060128770-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 KDM4E 3386/4885ALDH1A1 930/4885MAPT 320/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB KDM4E 4108/4885ALDH1A1 1690/4885MAPT 1121/4885

“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.