SCHEMBL24739232

SCHEMBL24739232

CCOC(=O)/C=C/[C@@H]1C[C@@H](Oc2ccc(F)cc2F)CN1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.41
GRIN1 Q05586 2/20 0.38
GRIN2B Q13224 2/20 0.38
GPR6 P46095 6/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.35
RBP4 P02753 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CCKBR P32239 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 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
SCHEMBL24739403 1.00 GPR119 (0.41) GPR119GRIN1GRIN2BGPR6RAB9A
SCHEMBL24739018 0.91 GPR119 (0.37) GPR119GRIN1GRIN2BMEN1KMT2A
SCHEMBL24739441 0.87 HRH3 (0.38) GPR119HRH3
SCHEMBL24739423 0.86 GPR119 (0.45) GPR119GRIN1GRIN2BGPR6RBP4
SCHEMBL24739223 0.86 GPR119 (0.45) GPR119GRIN1GRIN2BGPR6RBP4
SCHEMBL24739542 0.85 HRH3 (0.38) GPR119GRIN1GRIN2BMEN1KMT2A
SCHEMBL24739054 0.85 GPR119 (0.42) GPR119GRIN1GRIN2BALDH1A1MEN1
SCHEMBL24739388 0.81 USP30 (0.43) GPR119MEN1KMT2ATDP1
SCHEMBL24739557 0.81 GPR119 (0.36) GPR119GRIN1GRIN2BPDE4B
SCHEMBL24739228 0.80 P2RX3 (0.43) GPR119ALDH1A1MEN1KMT2ATDP1

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-2022253101-A1 PYRIDAZINONE COMPOUND AS PARP7 INHIBITOR 上海优理惠生医药有限公司 2022-12-08 WO disclosed