SCHEMBL4877026

SCHEMBL4877026

CC(=O)Nc1nc(/C=C/c2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.52
CDC25B P30305 2/20 0.52
DUSP3 P51452 2/20 0.52
CSNK2A2 P19784 1/20 0.49
CSNK2B P67870 1/20 0.49
CSNK2A1 P68400 1/20 0.49
MAPT P10636 7/20 0.48
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
USP2 O75604 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
RAB9A P51151 2/20 0.47
DYRK1A Q13627 1/20 0.47
ALDH1A1 P00352 2/20 0.46
POLB P06746 1/20 0.44
SNCA P37840 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL4876010 1.00 PTPN1 (0.52) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL4875999 1.00 PTPN1 (0.52) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL4867076 0.88 PIK3CD (0.57) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL4867086 0.88 PIK3CD (0.57) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL4866081 0.88 CSNK2A2 (0.48) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL4866085 0.88 CSNK2A2 (0.48) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL27626563 0.85 CSNK2A2 (0.48) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL3934386 0.82 CSNK2A2 (0.47) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL3934393 0.82 CSNK2A2 (0.47) PTPN1CDC25BDUSP3CSNK2A2CSNK2B
SCHEMBL3944068 0.79 DYRK1A (0.47) PTPN1CDC25BDUSP3CSNK2A2CSNK2B

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 PTPN1 2962/4885CDC25B 4318/4885DUSP3 1349/4885
US-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 PTPN1 530/4885CDC25B 4084/4885DUSP3 3857/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 PTPN1 2760/4885CDC25B 4054/4885DUSP3 1933/4885
US-20060128770-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 PTPN1 530/4885CDC25B 4084/4885DUSP3 3857/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB PTPN1 1362/4885CDC25B 4582/4885DUSP3 3019/4885

“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.