SCHEMBL4003319

SCHEMBL4003319

CCCc1nc2ccnn2c(=O)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.41
▸ POLB P06746 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ HTR2C P28335 2/20 0.36
▸ HTR2B P41595 2/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CDK2 P24941 1/20 0.35
▸ CDK7 P50613 1/20 0.35
▸ CDK9 P50750 1/20 0.35
▸ CDK13 Q14004 1/20 0.35
▸ CDK12 Q9NYV4 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ GSK3B P49841 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ SPR P35270 1/20 0.34
▸ KCNN3 Q9UGI6 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33

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
SCHEMBL18711468 0.87 L3MBTL1 (0.38) HTR2CHTR2BHTR2AGLASPR
SCHEMBL13890356 0.82 PDE10A (0.36) KMT2AHTR2CHTR2BHTR2AGSK3B
SCHEMBL3999675 0.80 GSK3B (0.43) MAPK1CDK2CDK9HTTGSK3B
SCHEMBL6517226 0.77 SPR (0.38) SPRKCNN3PDE10A
SCHEMBL4004452 0.75 HAVCR2 (0.39) HTR2CHTR2BCDK9GSK3BSPR
SCHEMBL15739828 0.71 PDE10A (0.38) HTR2CHTR2BHTR2ACDK2SPR
SCHEMBL18701564 0.71 USP2 (0.41) HTR2CHTR2BHTR2AMAPK1CDK2
SCHEMBL1487918 0.71 KMT2A (0.36) POLBKMT2AHTTHPGDKDM4E
SCHEMBL13875162 0.68 PDE10A (0.35) HTR2CHTR2BHTR2ASPRPDE10A
SCHEMBL9422938 0.67 GSK3B (0.44) KDM4CMAPK1GSK3BKDM4EPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009074677-A2 PYRAZOLOTRIAZINES 4SC AG (DE) 2009-06-18 — — WO disclosed
EP-2070932-A1 Pyrazolotriazines 4SC AG (DE) 2009-06-17 — — EP disclosed
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