SCHEMBL2562274

SCHEMBL2562274

CCCOc1ccc(C(=N)N)cc1C(=N)N

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 14/20 0.57
F2 P00734 2/20 0.54
PLAU P00749 2/20 0.54
ST14 Q9Y5Y6 2/20 0.54

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
SCHEMBL2563466 0.88 PTPN11 (0.53) PRSS1
SCHEMBL21823569 0.84 PRSS1 (0.74) PRSS1F2PLAUST14
SCHEMBL2567834 0.84 KDM4E (0.44) PRSS1F2PLAUST14
SCHEMBL2567575 0.83 F2 (0.42) PRSS1F2PLAUST14
SCHEMBL7962802 0.83 HTR2C (0.46) PRSS1
SCHEMBL5306761 0.83 PRSS1 (0.82) PRSS1F2PLAUST14
SCHEMBL2568322 0.83 SMN1; SMN2 (0.59) PRSS1F2PLAUST14
SCHEMBL7961007 0.83 HTR2B (0.46) PRSS1F2PLAUST14
SCHEMBL7962020 0.81 PRSS1 (0.47) PRSS1
Hydrochloric Acid SCHEMBL11629258 0.80 PRSS1 (0.48) PRSS1

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
EP-2383262-B1 PHENYL PYRIMIDONE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHODS AND USES THEREOF TOPHARMAN SHANGHAI CO LTD (CN) 2016-07-06 EP disclosed
US-8871777-B2 Phenylpyrimidone compounds, the pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO., LTD. (CN) 2014-10-28 US disclosed
US-8871777-B2 Phenylpyrimidone compounds, the pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO., LTD. (CN) 2014-10-28 US disclosed
US-8871777-B2 Phenylpyrimidone compounds, the pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO., LTD. (CN) 2014-10-28 US disclosed
EP-2383262-A1 PHENYL PYRIMIDONE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHODS AND USES THEREOF Topharman Shanghai Co., Ltd. (CN) 2011-11-02 EP disclosed