SCHEMBL30280433

SCHEMBL30280433

CCc1cc2cc(Br)cnc2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.50
PIK3CG P48736 1/20 0.41
ABL1 P00519 5/20 0.40
ALDH1A1 P00352 2/20 0.40
AURKA O14965 1/20 0.40
DAPK3 O43293 1/20 0.40
JAK2 O60674 1/20 0.40
PRKD3 O94806 1/20 0.40
MAP4K4 O95819 1/20 0.40
PAK4 O96013 1/20 0.40
NTRK1 P04629 1/20 0.40
FYN P06241 1/20 0.40
RET P07949 1/20 0.40
MET P08581 1/20 0.40
PDGFRB P09619 1/20 0.40
PIM1 P11309 1/20 0.40
FGFR1 P11362 1/20 0.40
PDGFRA P16234 1/20 0.40
FLT1 P17948 1/20 0.40
LTK P29376 1/20 0.40

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
SCHEMBL25153266 1.00 BRD4 (0.50) BRD4PIK3CGABL1ALDH1A1AURKA
SCHEMBL30280387 0.83 ABL1 (0.41) BRD4PIK3CGABL1ALDH1A1AURKA
SCHEMBL25153357 0.83 ABL1 (0.41) BRD4PIK3CGABL1ALDH1A1AURKA
SCHEMBL16537462 0.82 ABL1 (0.51) BRD4ABL1ALDH1A1AURKADAPK3
SCHEMBL13204738 0.80 BRD4 (0.55) BRD4PIK3CGABL1KDM4E
SCHEMBL1772724 0.79 BRD4 (0.50) BRD4PIK3CGABL1PDPK1
SCHEMBL20005176 0.79 BRD4 (0.50) BRD4PIK3CGABL1FGFR1
SCHEMBL22554256 0.78 ABL1 (0.37) BRD4ABL1ALDH1A1AURKADAPK3
SCHEMBL30731119 0.78 ABL1 (0.37) BRD4ABL1ALDH1A1AURKADAPK3
SCHEMBL25153572 0.77 GCK (0.38) BRD4ABL1ALDH1A1AURKADAPK3

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-2023064218-A1 TYRO3 INHIBITORS Halia Therapeutics, Inc. (US) 2023-04-20 WO disclosed