SCHEMBL3715010

SCHEMBL3715010

NCCCn1ccc2cnc(Nc3cccnc3)nc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 3/20 0.48
RPS6KA3 P51812 2/20 0.47
JAK2 O60674 6/20 0.44
JAK3 P52333 4/20 0.44
FGFR1 P11362 3/20 0.44
TYK2 P29597 3/20 0.44
AURKA O14965 2/20 0.44
EGFR P00533 2/20 0.44
CDK1 P06493 2/20 0.44
CDK2 P24941 2/20 0.44
DCLK1 O15075 1/20 0.44
PDPK1 O15530 1/20 0.44
ROCK2 O75116 1/20 0.44
PRKD3 O94806 1/20 0.44
MAP4K4 O95819 1/20 0.44
NTRK1 P04629 1/20 0.44
PRKCG P05129 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
LYN P07948 1/20 0.44

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
SCHEMBL3715005 0.83 PTK2 (0.46) PTK2RPS6KA3JAK2JAK3FGFR1
SCHEMBL15163478 0.83 CDK4 (0.53) RPS6KA3JAK2JAK3FGFR1TYK2
SCHEMBL3719414 0.82 PTK2 (0.45) PTK2RPS6KA3JAK2JAK3FGFR1
SCHEMBL15163166 0.81 RPS6KA3 (0.47) PTK2RPS6KA3JAK2JAK3FGFR1
SCHEMBL3714986 0.80 KDM4E (0.48) PTK2RPS6KA3JAK2JAK3FGFR1
SCHEMBL15163235 0.80 SYK (0.52) PTK2RPS6KA3JAK2JAK3FGFR1
SCHEMBL3716699 0.80 JAK2 (0.61) RPS6KA3JAK2JAK3TYK2ALK
SCHEMBL15163498 0.80 TBK1 (0.53) PTK2RPS6KA3JAK2JAK3FGFR1
SCHEMBL3719300 0.80 RPS6KA3 (0.46) PTK2RPS6KA3JAK2JAK3FGFR1
SCHEMBL3710051 0.79 JAK2 (0.44) PTK2RPS6KA3JAK2JAK3FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2403853-B1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS MEDICAL RES COUNCIL TECHNOLOGY (GB) 2013-08-14 EP claimed
WO-2010100431-A1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-09-10 WO claimed
EP-2403853-B1 PYRROLOPYRIMIDINES USED AS KINASE INHIBITORS MEDICAL RES COUNCIL TECHNOLOGY (GB) 2013-08-14 EP disclosed