SCHEMBL23109722

SCHEMBL23109722

COC(=O)[C@@]1(CO)CCCc2c1ccc(Cl)c2F

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EED O75530 2/20 0.34
▸ SUZ12 Q15022 2/20 0.34
▸ EZH2 Q15910 2/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ EPAS1 Q99814 1/20 0.34
▸ HPGD P15428 1/20 0.33
▸ TACR1 P25103 1/20 0.32
▸ TACR3 P29371 1/20 0.32
▸ CYP11B2 P19099 2/20 0.32
▸ CYP19A1 P11511 1/20 0.32
▸ SOD1 P00441 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ P2RX7 Q99572 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL23109717 0.85 HPGD (0.33) EEDSUZ12EZH2HPGDP2RX7
SCHEMBL23109716 0.85 HPGD (0.33) EEDSUZ12EZH2HPGDP2RX7
SCHEMBL23109718 0.85 HPGD (0.33) EEDSUZ12EZH2HPGDP2RX7
SCHEMBL23109719 0.82 EED (0.36) EEDSUZ12EZH2HIF1AEPAS1
SCHEMBL23109830 0.81 EED (0.50) EEDSUZ12EZH2HIF1AEPAS1
SCHEMBL23109720 0.79 EED (0.34) EEDSUZ12EZH2HIF1AEPAS1
SCHEMBL23109724 0.78 EED (0.34) EEDSUZ12EZH2HIF1AEPAS1
SCHEMBL21332605 0.75 KDM4C (0.43) TACR1TACR3SOD1
SCHEMBL21332603 0.75 KDM4C (0.43) TACR1TACR3SOD1
SCHEMBL21344576 0.75 KDM4C (0.43) TACR1TACR3SOD1

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-2021047616-A1 OXYNITRIDE HETEROCYCLIC HEPTANE-BASED SPIRO COMPOUND, INTERMEDIATE AND PREPARATION METHOD THEREFOR 苏州亚盛药业有限公司 2021-03-18 — — WO disclosed
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