SCHEMBL4875352

SCHEMBL4875352

CC(=O)Nc1nc(/C=C/c2ccc([N+](=O)[O-])cc2)cs1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.62
CSNK2A2 P19784 1/20 0.52
CSNK2B P67870 1/20 0.52
CSNK2A1 P68400 1/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
MAPT P10636 7/20 0.50
KDM4E B2RXH2 1/20 0.50
HSD17B10 Q99714 1/20 0.50
LMNA P02545 2/20 0.47
DYRK1A Q13627 1/20 0.47
NPC1 O15118 6/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GAA P10253 1/20 0.46
BACE1 P56817 1/20 0.45
HTT P42858 2/20 0.44
MAPK1 P28482 1/20 0.44
PIM1 P11309 1/20 0.44
ALDH1A1 P00352 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
SCHEMBL3932557 1.00 RAB9A (0.62) RAB9ACSNK2A2CSNK2BCSNK2A1MEN1
SCHEMBL3932546 1.00 RAB9A (0.62) RAB9ACSNK2A2CSNK2BCSNK2A1MEN1
SCHEMBL4875125 0.87 LMNA (0.65) RAB9AMEN1KMT2AMAPTKDM4E
SCHEMBL4875135 0.87 LMNA (0.65) RAB9AMEN1KMT2AMAPTKDM4E
SCHEMBL4863810 0.86 RAB9A (0.52) RAB9AMEN1KMT2AMAPTKDM4E
SCHEMBL4863816 0.86 RAB9A (0.52) RAB9AMEN1KMT2AMAPTKDM4E
SCHEMBL4882200 0.85 MAPT (0.48) RAB9ACSNK2A2CSNK2BCSNK2A1MEN1
SCHEMBL4877976 0.85 MAPT (0.48) RAB9ACSNK2A2CSNK2BCSNK2A1MEN1
SCHEMBL4877984 0.85 MAPT (0.48) RAB9ACSNK2A2CSNK2BCSNK2A1MEN1
SCHEMBL4873601 0.84 MAPT (0.49) RAB9AMEN1KMT2AMAPTKDM4E

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-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 (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 RAB9A 2149/4885CSNK2A2 4698/4885CSNK2B 4812/4885
US-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 RAB9A 1860/4885CSNK2A2 3188/4885CSNK2B 3390/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 RAB9A 3012/4885CSNK2A2 4565/4885CSNK2B 4793/4885
US-20060128770-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 RAB9A 1860/4885CSNK2A2 3188/4885CSNK2B 3390/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB RAB9A 340/4885CSNK2A2 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.