SCHEMBL24005769

SCHEMBL24005769

Cc1cc2cc[nH]c2nc1CC1COC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 4/20 0.36
▸ PIK3CD O00329 2/20 0.36
▸ MTOR P42345 2/20 0.36
▸ BRD4 O60885 1/20 0.31
▸ RIPK1 Q13546 1/20 0.31
▸ JAK2 O60674 1/20 0.30
▸ JAK1 P23458 1/20 0.30
▸ TYK2 P29597 1/20 0.30
▸ FGFR1 P11362 1/20 0.30
▸ KDR P35968 1/20 0.30

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
SCHEMBL25613150 0.82 ULK1 (0.31) PIK3CAPIK3CDMTOR
SCHEMBL25613142 0.73 PIK3CA (0.38) PIK3CAPIK3CDMTORJAK2JAK1
SCHEMBL24005771 0.73 PIK3CA (0.38) PIK3CAPIK3CDMTORJAK2JAK1
SCHEMBL24005751 0.71 TTK (0.40) PIK3CDBRD4
SCHEMBL9887640 0.68 AXL (0.42) PIK3CAPIK3CDBRD4RIPK1FGFR1
SCHEMBL11286572 0.67 AXL (0.39) PIK3CAPIK3CDBRD4RIPK1FGFR1
SCHEMBL25613146 0.67 CACNA1G (0.34) —
SCHEMBL24005741 0.64 RIPK1 (0.42) PIK3CAPIK3CDBRD4RIPK1FGFR1
SCHEMBL24005643 0.64 AXL (0.37) PIK3CAPIK3CDBRD4RIPK1JAK2
SCHEMBL25626100 0.64 PIK3CA (0.52) PIK3CAPIK3CDMTOR

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-2021223736-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON PHARMACEUTICALS, LTD. (CN) 2021-11-11 — — WO disclosed
Send feedback