SCHEMBL29337232

SCHEMBL29337232

O=C1COCc2cc(Br)cnc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
JAK2 O60674 1/20 0.33
PRKD3 O94806 1/20 0.33
MAP4K4 O95819 1/20 0.33
PAK4 O96013 1/20 0.33
ABL1 P00519 1/20 0.33
NTRK1 P04629 1/20 0.33
FYN P06241 1/20 0.33
RET P07949 1/20 0.33
MET P08581 1/20 0.33
PDGFRB P09619 1/20 0.33
PIM1 P11309 1/20 0.33
FGFR1 P11362 1/20 0.33
PDGFRA P16234 1/20 0.33
FLT1 P17948 1/20 0.33
LTK P29376 1/20 0.33
GRK5 P34947 1/20 0.33
KDR P35968 1/20 0.33

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
SCHEMBL29337231 0.79 DYRK1A (0.31) DYRK1AHTTKMT2A
SCHEMBL883082 0.76 MAOA (0.36) DYRK1AAURKADAPK3JAK2PRKD3
SCHEMBL29915220 0.76 MAOA (0.38) DYRK1AAURKADAPK3JAK2PRKD3
SCHEMBL25218349 0.76 MAOA (0.38) DYRK1AAURKADAPK3JAK2PRKD3
SCHEMBL29561118 0.76 MAOA (0.36) DYRK1AAURKADAPK3JAK2PRKD3
SCHEMBL16043515 0.76 DYRK1A (0.35) DYRK1AAURKADAPK3JAK2PRKD3
SCHEMBL31064173 0.75 ALDH1A1 (0.42) HTTKMT2A
SCHEMBL16415969 0.73 HTT (0.34) DYRK1AHTTKMT2A
SCHEMBL24747492 0.73 TDP1 (0.38) DYRK1AAURKADAPK3JAK2PRKD3
SCHEMBL31758550 0.72 HSD17B10 (0.37) ACVR1HSD17B10

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-2024148191-A1 MODULATORS OF TNF-α ACTIVITY FORWARD THERAPEUTICS, INC. (US) 2024-07-11 WO disclosed