SCHEMBL31639495

SCHEMBL31639495

CC(C)(C)OC(=O)N1CCC(c2ccc(-c3c(-c4nn(C5CCCC5)c5ncnc(N)c45)noc3C3CC3)nc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 4/20 0.49
▸ EGFR P00533 4/20 0.49
▸ SRC P12931 4/20 0.49
▸ PIK3CD O00329 2/20 0.49
▸ ABL1 P00519 2/20 0.49
▸ HCK P08631 2/20 0.49
▸ PIK3CA P42336 2/20 0.49
▸ PIK3CB P42338 2/20 0.49
▸ MTOR P42345 2/20 0.49
▸ PIK3CG P48736 2/20 0.49
▸ EPHB4 P54760 2/20 0.49
▸ PRKDC P78527 2/20 0.49
▸ PI4KB Q9UBF8 2/20 0.49
▸ RET P07949 10/20 0.45
▸ BTK Q06187 5/20 0.41
▸ TGFBR1 P36897 1/20 0.39
▸ LCK P06239 1/20 0.39
▸ ITK Q08881 1/20 0.39

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
SCHEMBL31639974 0.90 RET (0.47) KDREGFRSRCPIK3CDABL1
SCHEMBL31639990 0.83 TGFBR1 (0.41) KDREGFRSRCPIK3CDABL1
SCHEMBL31639321 0.83 RET (0.41) KDREGFRSRCPIK3CDABL1
SCHEMBL31639786 0.82 RET (0.48) KDREGFRSRCPIK3CDABL1
Hydrochloric Acid SCHEMBL31640040 0.81 RET (0.51) KDREGFRSRCPIK3CDABL1
SCHEMBL31640437 0.81 SRC (0.42) KDREGFRSRCPIK3CDABL1
SCHEMBL31639403 0.81 SRC (0.42) KDREGFRSRCPIK3CDABL1
SCHEMBL31640192 0.80 RET (0.48) KDREGFRSRCPIK3CDABL1
SCHEMBL31639555 0.80 TGFBR1 (0.39) KDREGFRSRCPIK3CDABL1
SCHEMBL31639556 0.79 RET (0.48) KDREGFRSRCPIK3CDABL1

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-2025137605-A1 COMPOUNDS FOR TARGETED DEGRADATION OF PROTO-ONCOGENE TYROSINE PROTEIN KINASE RECEPTOR C4 THERAPEUTICS, INC. (US) 2025-06-26 — — WO disclosed
Send feedback