SCHEMBL14833337

SCHEMBL14833337

O=C(c1ccccc1)n1nc(-c2ccccn2)nc1NCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 18/20 1.00
KLK1 P06870 3/20 1.00
F2 P00734 6/20 0.85
F10 P00742 6/20 0.85

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
SCHEMBL14688600 0.95 KLKB1 (0.91) KLKB1KLK1F2F10
SCHEMBL14688287 0.94 KLKB1 (0.89) KLKB1KLK1F2F10
SCHEMBL2547690 0.93 KLKB1 (0.87) KLKB1KLK1F2F10
SCHEMBL14845921 0.93 KLKB1 (1.00) KLKB1KLK1F2F10
SCHEMBL20506370 0.92 KLKB1 (1.00) KLKB1KLK1F2F10
SCHEMBL14688741 0.92 KLKB1 (0.85) KLKB1KLK1F2F10
SCHEMBL14688308 0.92 KLKB1 (0.85) KLKB1KLK1F2F10
SCHEMBL2551329 0.91 KLKB1 (0.83) KLKB1KLK1F2F10
SCHEMBL14688297 0.91 KLKB1 (0.83) KLKB1KLK1F2F10
SCHEMBL2550221 0.91 KLKB1 (0.82) KLKB1KLK1F2F10

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013049591-A2 DUAL INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF VERSEON CORPORATION (US) 2013-04-04 WO claimed
EP-3421036-B1 MULTISUBSTITUTED AROMATIC COMPOUNDS AS SERINE PROTEASE INHIBITORS VERSEON CORP (US) 2020-11-18 EP disclosed
EP-3421036-A1 MULTISUBSTITUTED AROMATIC COMPOUNDS AS SERINE PROTEASE INHIBITORS Verseon Corporation (US) 2019-01-02 EP disclosed
EP-2968297-B1 MULTISUBSTITUTED AROMATIC COMPOUNDS AS SERINE PROTEASE INHIBITORS VERSEON CORP (US) 2018-09-26 EP disclosed
WO-2013049591-A2 DUAL INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF VERSEON CORPORATION (US) 2013-04-04 WO disclosed