SCHEMBL9720644

SCHEMBL9720644

CCCOC(=O)/C(Cl)=C(/Cl)C(=O)OCCC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.41
ALDH1A1 P00352 6/20 0.40
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 4/20 0.39
LMNA P02545 2/20 0.39
TDP1 Q9NUW8 2/20 0.38
ESR1 P03372 1/20 0.38
CHRM1 P11229 1/20 0.38
SLC6A2 P23975 1/20 0.38
KDR P35968 1/20 0.38
THRB P10828 1/20 0.35
TP53 P04637 1/20 0.35
ATM Q13315 1/20 0.34
NAAA Q02083 1/20 0.33
DGKA P23743 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33

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
SCHEMBL9720649 1.00 HCAR2 (0.41) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL28810132 0.90 HCAR2 (0.39) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL9720591 0.85 ALDH1A1 (0.56) HCAR2ALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL9720593 0.85 ALDH1A1 (0.56) HCAR2ALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL9720620 0.84 LMNA (0.38) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL9720615 0.84 LMNA (0.38) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL9408854 0.84
SCHEMBL26670087 0.83 TSHR (0.59) HCAR2ALDH1A1TSHRLMNATP53
SCHEMBL138475 0.83 HCAR2 (0.48) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL7184710 0.83 HCAR2 (0.34) HCAR2ALDH1A1GAASMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108878-A Organic polymer carrier and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN claimed
CN-117126313-A Catalyst solid component for olefin polymerization, preparation method and application thereof 中国科学院化学研究所 2023-11-28 CN claimed
WO-2023221562-A1 CATALYST SOLID COMPONENT FOR OLEFIN POLYMERIZATION, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 中国科学院化学研究所 2023-11-23 WO claimed
CN-118108878-A Organic polymer carrier and preparation method and application thereof 中国石油天然气股份有限公司 2024-05-31 CN disclosed
CN-117126313-B Catalyst solid component for olefin polymerization, preparation method and application thereof 中国科学院化学研究所 2024-03-22 CN disclosed
CN-117126313-A Catalyst solid component for olefin polymerization, preparation method and application thereof 中国科学院化学研究所 2023-11-28 CN disclosed
WO-2023221562-A1 CATALYST SOLID COMPONENT FOR OLEFIN POLYMERIZATION, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 中国科学院化学研究所 2023-11-23 WO disclosed
US-5101067-A Chemical intermediates for pyridinedicarboxylic acid esters, herbicides WACKER-CHEMIE GMBH (DE) 1992-03-31 US disclosed
US-5008392-A Reacting 2,3-dihalomaleic acid esters with ammonia or salts, reacting product with alpha, B-unsaturated aldehydes or ketones WACKER-CHEMIE GMBH (DE) 1991-04-16 US disclosed
EP-0371499-A2 Process for the preparation of pyridine-2,3-dicarboxylic-acid esters WACKER-CHEMIE GMBH (DE) 1990-06-06 EP disclosed