SCHEMBL4876043

SCHEMBL4876043

CCS(=O)(=O)c1ccc(Cc2sc(NC(C)=O)nc2C=Cc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.45
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
PTPN1 P18031 1/20 0.42
CDC25B P30305 1/20 0.42
DUSP3 P51452 1/20 0.42
DYRK1A Q13627 1/20 0.42
AOC3 Q16853 5/20 0.41
PLTP P55058 3/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL4876040 1.00 RORC (0.45) RORCCSNK2A2CSNK2BCSNK2A1PTPN1
SCHEMBL3939278 0.93 AOC3 (0.49) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B
SCHEMBL3933218 0.93 CSNK2A2 (0.43) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B
SCHEMBL3941424 0.93 AOC3 (0.49) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B
SCHEMBL3939275 0.93 AOC3 (0.49) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B
SCHEMBL3933223 0.93 CSNK2A2 (0.43) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B
SCHEMBL4870874 0.89 CSNK2A2 (0.45) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B
SCHEMBL4878118 0.89 CSNK2A2 (0.45) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B
SCHEMBL4870880 0.89 CSNK2A2 (0.45) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B
SCHEMBL3934386 0.89 CSNK2A2 (0.47) CSNK2A2CSNK2BCSNK2A1PTPN1CDC25B

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-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-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
US-20060128770-A1 Thiazole derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2006-06-15 US 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-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 RORC 4786/4885CSNK2A2 4698/4885CSNK2B 4812/4885
US-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 RORC 2850/4885CSNK2A2 3188/4885CSNK2B 3390/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 RORC 4550/4885CSNK2A2 4565/4885CSNK2B 4793/4885
US-20060128770-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 RORC 2850/4885CSNK2A2 3188/4885CSNK2B 3390/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB RORC 4020/4885CSNK2A2 3949/4885CSNK2B 4150/4885

“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.