SCHEMBL1446320

SCHEMBL1446320

N=C(N)c1ccc(C[C]=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 5/20 0.57
PRSS3 P35030 4/20 0.57
PRSS2 P07478 3/20 0.57
F10 P00742 2/20 0.57
LOXL2 Q9Y4K0 1/20 0.57
F2 P00734 6/20 0.52
PLG P00747 1/20 0.52
C1S P09871 1/20 0.52
ST14 Q9Y5Y6 3/20 0.48
TMPRSS6 Q8IU80 1/20 0.48
LMNA P02545 2/20 0.46
PLAU P00749 2/20 0.46
MASP2 O00187 1/20 0.46
THPO P40225 1/20 0.46
APEX1 P27695 1/20 0.45
PRMT5 O14744 1/20 0.43
PRMT1 Q99873 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
SCHEMBL7366568 0.81 PLA2G10 (0.59)
SCHEMBL1445806 0.80 PRSS1 (0.53) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL2717268 0.80 PRSS1 (0.70) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL18324125 0.79 PRSS1 (0.57) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL11139354 0.76 CYP3A4 (0.42)
SCHEMBL1445939 0.76 PRSS1 (0.48) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL1587085 0.76 PRSS1 (0.64) PRSS1PRSS3PRSS2F10LOXL2
SCHEMBL11788529 0.75 CYP2C9 (0.42) PRSS1F2ST14
SCHEMBL1446332 0.75 KMT2A (0.39) PRSS1PRSS3PRSS2F2PLG
SCHEMBL7719735 0.75 PRSS1 (0.52) PRSS1PRSS3PRSS2F10LOXL2

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2366786-A2 Cytokine receptor modulators and uses thereof VALORISATION HSJ, Société en Commandite (CA) 2011-09-21 EP claimed
EP-2288621-A2 IL-23 RECEPTOR ANTAGONISTS AND USES THEREOF Valorisation HSJ, Societe en Commandite (CA) 2011-03-02 EP claimed
EP-1885855-A4 CYTOKINE RECEPTOR MODULATORS AND USES THEREOF VALORISATION HSJ SOC EN COMMAN (CA) 2009-03-04 EP claimed
US-20090048161-A1 Cytokine receptor modulators and uses thereof VALORISATION HSJ, SOCIETE EN COMMANDITE (CA) 2009-02-19 US claimed
WO-2009007849-A2 IL-23 RECEPTOR ANTAGONISTS AND USES THEREOF VALORISATION HSJ, SOCIETE EN COMMANDITE (CA) 2009-01-15 WO claimed
EP-1751175-A4 INTERLEUKIN-1 RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS OF TREATMENT VALORISATION RECH SOC EN COMMA (CA) 2008-12-17 EP claimed
EP-1885855-A2 CYTOKINE RECEPTOR MODULATORS AND USES THEREOF VALORISATION HSJ, Société en Commandite (CA) 2008-02-13 EP claimed
EP-1751175-A1 INTERLEUKIN-1 RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS OF TREATMENT Valorisation-Recherche, Société en Commandite (CA) 2007-02-14 EP claimed
WO-2007004060-A2 CYTOKINE RECEPTOR MODULATORS AND USES THEREOF VALORISATION HSJ, SOCIETE EN COMMANDITE (CA) 2007-01-11 WO claimed
US-20060094663-A1 Interleukin-1 receptor antagonists, compositions, and methods of treatment VALORISATION-RECHERCHE, SOCIETE EN COMMANDITE (CA) 2006-05-04 US claimed
WO-2005105830-A1 INTERLEUKIN-1 RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS OF TREATMENT VALORISATION-RECHERCHE, SOCIETE EN COMMANDITE (CA) 2005-11-10 WO claimed
EP-0384362-B1 Glycinderivatives HOFFMANN LA ROCHE (CH) 1999-12-15 EP claimed
US-5663297-A OLIGOPEPTIDES HOFFMANN-LA ROCHE INC. (US) 1997-09-02 US claimed
EP-0384362-A2 Glycinderivatives F. HOFFMANN-LA ROCHE AG (CH) 1990-08-29 EP claimed
US-8802818-B2 Prostaglandin-F2 alpha receptor modulators and uses thereof LUBELL WILLIAM D (CA) 2014-08-12 US disclosed
US-8618054-B2 Interleukin-1 receptor antagonists, compositions, and methods of treatment Valorisation-Rechereche Société en Commandite (CA) 2013-12-31 US disclosed
US-20120309690-A1 PROSTAGLANDIN-F2 ALPHA RECEPTOR MODULATORS AND USES THEREOF LUBELL WILLIAM D (CA) 2012-12-06 US disclosed
CN-1202893-A Novel isoxazoline and isoxazole fibrinogen receptor antagonists DU PONT MERCK PHARMA (US) 1998-12-23 CN disclosed
US-5663297-A OLIGOPEPTIDES HOFFMANN-LA ROCHE INC. (US) 1997-09-02 US disclosed
EP-0384362-A2 Glycinderivatives F. HOFFMANN-LA ROCHE AG (CH) 1990-08-29 EP 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 (1 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-20120309690-A1 PROSTAGLANDIN-F2 ALPHA RECEPTOR MODULATORS AND USES THEREOF PTGFR, PTGER1, PTGER2 PRSS1 1539/4885PRSS3 2355/4885PRSS2 1635/4885

“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.