SCHEMBL30880747

SCHEMBL30880747

COc1cc(Nc2ccnc3cc(OC)c(OC)cc23)cc(-c2ccoc2)c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAK O14976 13/20 0.59
RIPK2 O43353 6/20 0.59
COQ8A Q8NI60 6/20 0.59
NLK Q9UBE8 6/20 0.59
EGFR P00533 5/20 0.59
SRC P12931 3/20 0.59
LCK P06239 3/20 0.59
EPHB6 O15197 3/20 0.59
ABL1 P00519 3/20 0.59
EPHA1 P21709 2/20 0.59
EPHA8 P29322 2/20 0.59
ACVR1 Q04771 2/20 0.59
BMPR1B O00238 1/20 0.59
MAP2K5 Q13163 1/20 0.59
PDGFRA P16234 1/20 0.53
FGFR2 P21802 1/20 0.46
TXK P42681 1/20 0.44
STK16 O75716 1/20 0.44
AAK1 Q2M2I8 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
SCHEMBL30880530 0.88 PDGFRA (0.48) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880521 0.85 GAK (0.62) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880754 0.85 GAK (0.62) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880610 0.85 GAK (0.58) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880645 0.85 GAK (0.58) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880708 0.85 GAK (0.75) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880484 0.83 GAK (0.66) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880647 0.83 GAK (0.59) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880502 0.82 GAK (0.51) GAKRIPK2COQ8ANLKEGFR
SCHEMBL30880463 0.82 GAK (0.58) GAKRIPK2COQ8ANLKEGFR

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-2024078513-A1 CONDENSED AZINES FOR TREATING CANCER CHENGDU ANTICANCER BIOSCIENCE , LTD. (CN) 2024-04-18 WO disclosed