SCHEMBL30718698

SCHEMBL30718698

COCc1cnc2ccc(Br)cc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.43
MALT1 Q9UDY8 1/20 0.40
PDGFRB P09619 2/20 0.38
PDGFRA P16234 2/20 0.38
TSHR P16473 2/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HTT P42858 1/20 0.36
POLB P06746 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
ALPL P05186 2/20 0.35
BACE1 P56817 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PI4KA P42356 1/20 0.35

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
SCHEMBL27140044 1.00 PDE10A (0.43) PDE10AMALT1PDGFRBPDGFRATSHR
SCHEMBL12850737 0.85 MALT1 (0.38) PDE10AMALT1PDGFRBPDGFRAMEN1
SCHEMBL8108097 0.82 PDE10A (0.60) PDE10APDGFRBPDGFRACYP11B1CYP11B2
SCHEMBL18562139 0.81 CYP1A2 (0.40) PDE10AMALT1TSHRRAB9AMEN1
SCHEMBL8813587 0.81 CYP11B1 (0.55) PDE10APDGFRBPDGFRARAB9AMEN1
SCHEMBL8099185 0.81 PDE10A (0.43) PDE10APDGFRBPDGFRACYP11B1CYP11B2
SCHEMBL3150525 0.78 CYP1A2 (0.52) PDE10APDGFRBPDGFRAKMT2AHTT
SCHEMBL2621781 0.78 BACE1 (0.38) PDE10AMALT1RAB9AMEN1LMNA
SCHEMBL2621783 0.77 HTT (0.39) MALT1PDGFRBPDGFRALMNAHTT
SCHEMBL30718868 0.77 ALDH1A1 (0.43) PDE10APDGFRBPDGFRATSHRRAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4547658-A1 WEE1 DEGRADING COMPOUNDS AND USES THEREOF Bristol-Myers Squibb Company (US) 2025-05-07 EP disclosed
CN-119325469-A WEE1 degrading compounds and uses thereof 百时美施贵宝公司 2025-01-17 CN disclosed
WO-2024006881-A1 WEE1 DEGRADING COMPOUNDS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY (US) 2024-01-04 WO disclosed