SCHEMBL19629293

SCHEMBL19629293

Cc1nc(C(=N)N)cn2ccnc12

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
NUDT1 P36639 1/20 0.35
TNKS O95271 1/20 0.33
SYK P43405 10/20 0.32
PARP1 P09874 1/20 0.31
CD63 P08962 2/20 0.31

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
SCHEMBL19616357 0.80 L3MBTL1 (0.33) L3MBTL1NUDT1SYK
SCHEMBL31244474 0.75 KDM4E (0.42) L3MBTL1SYK
SCHEMBL31244547 0.75 L3MBTL1 (0.37) L3MBTL1TNKSSYK
SCHEMBL17318003 0.75 AURKA (0.40) SYKPARP1CD63
SCHEMBL17324666 0.75 L3MBTL1 (0.30) L3MBTL1
SCHEMBL19630404 0.74 NUDT1 (0.45) L3MBTL1NUDT1TNKSSYKCD63
SCHEMBL15687846 0.73 L3MBTL1 (0.47) L3MBTL1NUDT1TNKSSYK
SCHEMBL22732873 0.73 L3MBTL1 (0.32) L3MBTL1SYK
SCHEMBL31244472 0.73 KDM4E (0.59)
SCHEMBL24714425 0.71 L3MBTL1 (0.33) L3MBTL1SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017200825-A1 FUSED PYRAZINE DERIVATIVES USEFUL AS SOLUBLE GUANYLATE CYCLASE STIMULATORS MERCK SHARP & DOHME CORP. (US) 2017-11-23 WO disclosed