SCHEMBL6237954

SCHEMBL6237954

N=C(NN)c1cc[c]cc1

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
C1S P09871 1/20 0.30
PRSS3 P35030 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL2849627 0.82 MPO (0.39) PRSS1PRSS2PRSS3
SCHEMBL3284107 0.78
SCHEMBL950244 0.76
SCHEMBL3557897 0.75 F2 (0.52) PRSS1PRSS2C1SPRSS3RECQL
SCHEMBL13108737 0.75 WDR5 (0.44)
SCHEMBL10817380 0.74 PRSS1 (0.33) PRSS1PRSS2C1SPRSS3RECQL
SCHEMBL6280064 0.74 PRSS1 (0.34) PRSS1PRSS2C1SPRSS3RECQL
SCHEMBL2945608 0.73 LMNA (0.54) RECQLKMT2A
Iodide SCHEMBL6313064 0.73 F2 (0.50) PRSS1PRSS2C1SPRSS3RECQL
Hydrochloric Acid SCHEMBL3557093 0.73 BLM (0.54) PRSS1PRSS2C1SPRSS3RECQL

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-0907656-A1 NOVEL ANTICOAGULANT GLYCOSIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1999-04-14 EP claimed
WO-1997049716-A1 NOVEL ANTICOAGULANT GLYCOSIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF Richter Gedeon Vegyészeti Gyár Rt. (HU) 1997-12-31 WO claimed
EP-0836613-B1 WATER-SOLUBLE ADENOSINE KINASE INHIBITORS METABASIS THERAPEUTICS INC (US) 2005-05-25 EP disclosed
EP-0907656-A1 NOVEL ANTICOAGULANT GLYCOSIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1999-04-14 EP disclosed
US-5795977-A Water soluble adenosine kinase inhibitors METABASIS THERAPEUTICS, INC. (US) 1998-08-18 US disclosed
EP-0836613-A1 WATER-SOLUBLE ADENOSINE KINASE INHIBITORS GENSIA, INC. (US) 1998-04-22 EP disclosed
US-5726302-A SUBSTITUTED 4-AMINO PYRROLO(2,3-D) PYRIMIDINE AND PYRAZOLO(3,4-D) PYRIMIDINE NUCLEOSIDE ANALOGS GENSIA INC. (US) 1998-03-10 US disclosed
WO-1997049716-A1 NOVEL ANTICOAGULANT GLYCOSIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF Richter Gedeon Vegyészeti Gyár Rt. (HU) 1997-12-31 WO disclosed
WO-1996040707-A1 WATER-SOLUBLE ADENOSINE KINASE INHIBITORS GENSIA SICOR (US) 1996-12-19 WO disclosed