SCHEMBL29952114

SCHEMBL29952114

OB(O)c1cc2ccccc2cc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
TRPM4 Q8TD43 1/20 0.43
GAA P10253 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
STAT3 P40763 1/20 0.42
CYP1A2 P05177 2/20 0.41
ALOX5 P09917 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
DAO P14920 2/20 0.38
MITF O75030 1/20 0.38
MAPT P10636 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
CYP2A6 P11509 1/20 0.38
MGLL Q99685 2/20 0.38

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
SCHEMBL4202551 1.00 CA1 (0.46) CA1CA2TRPM4GAAKDM4E
SCHEMBL30944694 0.85 CA1 (0.54) CA1CA2KDM4ECYP1A2TDP1
Boric Acid SCHEMBL31519492 0.79 ALOX5 (0.50) CA1CA2TRPM4GAAKDM4E
Boric Acid SCHEMBL28339002 0.79 ALOX5 (0.50) CA1CA2TRPM4GAAKDM4E
SCHEMBL25365977 0.77 CYP2A6 (0.43) CA1CA2KDM4EALDH1A1HPGD
SCHEMBL25363704 0.77 CYP2A6 (0.43) CA1CA2KDM4EALDH1A1HPGD
SCHEMBL29954941 0.76 CA1 (0.46) CA1CA2KDM4EALDH1A1CYP1A2
SCHEMBL4592717 0.76 SELL (0.33) CA1CA2KDM4EALDH1A1HPGD
SCHEMBL29750056 0.76 TRPM4 (0.57) CA2TRPM4GAAKDM4EALDH1A1
SCHEMBL28653 0.76 TRPM4 (0.57) CA2TRPM4GAAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119751364-A Dimethoxy quinazoline compound and application thereof 中日友好医院(中日友好临床医学研究所) 2025-04-04 CN claimed
CN-118515534-B Multi-tooth ligand, multi-tooth ligand metal catalyst, and preparation method and application thereof 华南理工大学 2024-11-05 CN claimed
CN-118515534-A Multi-tooth ligand, multi-tooth ligand metal catalyst, and preparation method and application thereof 华南理工大学 2024-08-20 CN claimed
CN-120118071-A Quinazoline compound and application thereof 北京化工大学 2025-06-10 CN disclosed
CN-119751364-A Dimethoxy quinazoline compound and application thereof 中日友好医院(中日友好临床医学研究所) 2025-04-04 CN disclosed
CN-118515534-B Multi-tooth ligand, multi-tooth ligand metal catalyst, and preparation method and application thereof 华南理工大学 2024-11-05 CN disclosed
CN-118515534-A Multi-tooth ligand, multi-tooth ligand metal catalyst, and preparation method and application thereof 华南理工大学 2024-08-20 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed