SCHEMBL6915290

SCHEMBL6915290

Oc1n[nH]c2c1nnc1cc(-c3ccccc3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.41
DYRK1A Q13627 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
DHFR P00374 1/20 0.37
CHEK1 O14757 4/20 0.36
MKNK1 Q9BUB5 1/20 0.35
ALK Q9UM73 2/20 0.35
PRMT5 O14744 1/20 0.35
FGFR1 P11362 3/20 0.35
CDK4 P11802 1/20 0.35
CCNA2 P20248 1/20 0.35
CCND1 P24385 1/20 0.35
CDK2 P24941 1/20 0.35
CCND3 P30281 1/20 0.35
KDR P35968 1/20 0.35
ALOX5 P09917 1/20 0.35
FGFR2 P21802 2/20 0.35
FGFR3 P22607 2/20 0.35
GSK3B P49841 2/20 0.34
GSK3A P49840 1/20 0.34

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
SCHEMBL6921370 0.89 JAK2 (0.41) JAK2DYRK1ADYRK1BCHEK1MKNK1
SCHEMBL6921256 0.80 CDK2 (0.39) CHEK1ALKCDK2GSK3BGSK3A
SCHEMBL6918858 0.80 GPR3 (0.45) DYRK1ADYRK1BCHEK1FGFR1KDR
SCHEMBL30896407 0.80 GPR3 (0.45) DYRK1ADYRK1BCHEK1FGFR1KDR
SCHEMBL6914017 0.73 MAP4K4 (0.42) CHEK1GSK3BLRRK2
SCHEMBL6919545 0.73 NMT2 (0.49) PRMT5CDK2KDRGSK3B
SCHEMBL6920030 0.70 DYRK1A (0.53) DYRK1ADYRK1BCHEK1FGFR1
SCHEMBL6917877 0.69 ERN1 (0.40) CHEK1ALKCDK4CCND1CDK2
SCHEMBL29216870 0.69 GPR3 (0.58) JAK2DHFRALKALOX5LRRK2
SCHEMBL28953289 0.65 PRMT5 (0.49) JAK2DYRK1ADYRK1BDHFRCHEK1

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-2004016615-A1 PYRAZOLO (4,3c) CINNOLINE COMPOUNDS AS INHIBITORS OF ITK KINASE ACTIVITY ASTRAZENECA AB (SE) 2004-02-26 WO claimed
WO-2004016615-A1 PYRAZOLO (4,3c) CINNOLINE COMPOUNDS AS INHIBITORS OF ITK KINASE ACTIVITY ASTRAZENECA AB (SE) 2004-02-26 WO disclosed