SCHEMBL28055281

SCHEMBL28055281

Oc1ccc(-c2ccn(-c3ccnc4[nH]ccc34)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 4/20 0.46
MAPK1 P28482 1/20 0.44
RIPK1 Q13546 1/20 0.44
AKT2 P31751 1/20 0.40
NUDT1 P36639 5/20 0.38
AXL P30530 1/20 0.38
IKBKB O14920 2/20 0.38
CHUK O15111 2/20 0.38
PBK Q96KB5 2/20 0.38
DAPK3 O43293 1/20 0.38
JAK2 O60674 1/20 0.38
PRKD3 O94806 1/20 0.38
MAP4K4 O95819 1/20 0.38
PAK4 O96013 1/20 0.38
CSF1R P07333 1/20 0.38
RET P07949 1/20 0.38
IGF1R P08069 1/20 0.38
FGFR1 P11362 1/20 0.38
PRKACA P17612 1/20 0.38
FLT1 P17948 1/20 0.38

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
SCHEMBL100645 0.87 MAPK14 (0.48) PRKCIMAPK1AKT2NUDT1AXL
SCHEMBL29540449 0.87 PRKCI (0.46) PRKCIAKT2NUDT1AXLIKBKB
SCHEMBL102456 0.87 PRKCI (0.46) PRKCIAKT2NUDT1AXLIKBKB
SCHEMBL29540558 0.87 MAPK14 (0.48) PRKCIMAPK1AKT2NUDT1AXL
SCHEMBL29540619 0.87 JAK2 (0.52) PRKCIMAPK1AKT2NUDT1IKBKB
SCHEMBL100939 0.87 JAK2 (0.52) PRKCIMAPK1AKT2NUDT1IKBKB
SCHEMBL5134218 0.86 CDC7 (0.44) PRKCIAKT2NUDT1IKBKBCHUK
SCHEMBL29540798 0.84 MAPK1 (0.47) PRKCIMAPK1AKT2ROCK1CIT
SCHEMBL100644 0.84 MAPK1 (0.47) PRKCIMAPK1AKT2ROCK1CIT
SCHEMBL99492 0.84 PRKCI (0.43) PRKCIRIPK1AKT2NUDT1AXL

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
CN-103254190-B Heteroaryl substituted pyrrolo-[2,3-b] pyridine and pyrrolo-[2,3-b] pyrimidine as Janus inhibitors of kinases 因塞特控股公司 2016-12-07 CN disclosed
CN-103214484-B Pyrrolo-[2,3-b] pyridine replaced as the heteroaryl of Janus inhibitors of kinases and pyrrolo-[2,3-b] pyrimidine 因塞特控股公司 2016-07-06 CN disclosed