SCHEMBL31329428

SCHEMBL31329428

COCc1cc(=O)cc(COC)o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.46
NQO1 P15559 1/20 0.39
HSD17B3 P37058 1/20 0.36
EGFR P00533 1/20 0.35
MAPT P10636 1/20 0.34
POLB P06746 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
APEX1 P27695 1/20 0.33
KCNA2 P16389 1/20 0.33
KCNA1 Q09470 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
PKM P14618 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 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
SCHEMBL31329423 0.88 DAO (0.39) DAONQO1HSD17B3EGFRMAPT
SCHEMBL31329406 0.77 ALOX5 (0.37) NQO1POLBTDP1L3MBTL1NPC1
SCHEMBL31329411 0.74 CA12 (0.33) NQO1MAPTKDM4EALDH1A1HPGD
SCHEMBL55096 0.74 DAO (0.38) DAOHSD17B3MAPTPOLBTDP1
SCHEMBL31329401 0.71 ALDH1A1 (0.40) MAPTL3MBTL1NPC1RAB9ALMNA
SCHEMBL31329431 0.71 ALDH1A1 (0.46) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL31329403 0.70 GPR84 (0.37) MAPTTDP1L3MBTL1NPC1RAB9A
SCHEMBL31329425 0.70 DAO (0.54) DAOHSD17B3MAPTTDP1L3MBTL1
SCHEMBL31329420 0.69 GPR84 (0.40) MAPTTDP1ALDH1A1
SCHEMBL11241594 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119331143-B Catalyst component for olefin polymerization, catalyst and application thereof 中国石油天然气股份有限公司 2026-02-27 CN claimed
CN-119331135-A Olefin polymerization catalyst component, olefin polymerization catalyst and application thereof 中国石油天然气股份有限公司 2025-01-21 CN claimed
CN-119331143-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油天然气股份有限公司 2025-01-21 CN claimed
CN-119331135-A Olefin polymerization catalyst component, olefin polymerization catalyst and application thereof 中国石油天然气股份有限公司 2025-01-21 CN disclosed
CN-119331143-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油天然气股份有限公司 2025-01-21 CN disclosed