SCHEMBL4877043

SCHEMBL4877043

COC(=O)c1ccc(Cc2sc(NC(C)=O)nc2/C=C/c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.48
PLTP P55058 3/20 0.43
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
DYRK1A Q13627 1/20 0.41
MAPT P10636 4/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
POLB P06746 1/20 0.41
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
PTGS2 P35354 1/20 0.40
RAB9A P51151 1/20 0.39
PKM P14618 1/20 0.39
OGA O60502 1/20 0.39

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
SCHEMBL4870512 1.00 AOC3 (0.48) AOC3PLTPCSNK2A2CSNK2BCSNK2A1
SCHEMBL4870505 1.00 AOC3 (0.48) AOC3PLTPCSNK2A2CSNK2BCSNK2A1
SCHEMBL4878118 0.88 CSNK2A2 (0.45) PLTPCSNK2A2CSNK2BCSNK2A1KMT2A
SCHEMBL4870874 0.88 CSNK2A2 (0.45) PLTPCSNK2A2CSNK2BCSNK2A1KMT2A
SCHEMBL4870880 0.88 CSNK2A2 (0.45) PLTPCSNK2A2CSNK2BCSNK2A1KMT2A
SCHEMBL3934386 0.88 CSNK2A2 (0.47) AOC3PLTPCSNK2A2CSNK2BCSNK2A1
SCHEMBL3934393 0.88 CSNK2A2 (0.47) AOC3PLTPCSNK2A2CSNK2BCSNK2A1
SCHEMBL4876043 0.86 RORC (0.45) AOC3PLTPCSNK2A2CSNK2BCSNK2A1
SCHEMBL3931382 0.86 AOC3 (0.47) AOC3PLTPCSNK2A2CSNK2BCSNK2A1
SCHEMBL3933223 0.86 CSNK2A2 (0.43) AOC3PLTPCSNK2A2CSNK2BCSNK2A1

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 9 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
US-7442715-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2008-10-28 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
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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 AOC3 782/4885PLTP 2813/4885CSNK2A2 3188/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 AOC3 85/4885PLTP 1523/4885CSNK2A2 4565/4885
US-20060128770-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 AOC3 782/4885PLTP 2813/4885CSNK2A2 3188/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB AOC3 590/4885PLTP 1390/4885CSNK2A2 3949/4885

“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.