SCHEMBL28420108

SCHEMBL28420108

CP(Cl)Cl.Oc1cccc(N(O)O)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
LMNA P02545 2/20 0.42
HPGD P15428 2/20 0.42
ALOX15 P16050 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ADAMTS4 O75173 1/20 0.42
EGFR P00533 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
FYN P06241 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
CA6 P23280 1/20 0.42
CDK2 P24941 1/20 0.42
MMP12 P39900 1/20 0.42
RECQL P46063 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ADAMTS5 Q9UNA0 1/20 0.42
TRPA1 O75762 2/20 0.40

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
SCHEMBL29912413 0.87 ALDH1A1 (0.55) ALDH1A1LMNAHPGDALOX15HSD17B10
Sulfuric Acid SCHEMBL28421633 0.77 CDK2 (0.39) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL30022761 0.72 ALDH1A1 (0.52) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL5494774 0.72 ALDH1A1 (0.52) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL10582290 0.68 ALDH1A1 (0.50) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL23850516 0.67 HPGD (0.46) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL30956244 0.67 HPGD (0.46) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL30022372 0.67 ALDH1A1 (0.46) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL5680576 0.67 ALDH1A1 (0.46) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL8580333 0.65 ALDH1A1 (0.44) ALDH1A1LMNAHPGDALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111375429-B Preparation method of vulcanized hydrogenation catalyst 中国石油化工股份有限公司 2022-10-11 CN claimed
CN-111378489-B Startup method of hydrogenation device 中国石油化工股份有限公司 2021-01-05 CN claimed
CN-111378489-A Startup method of hydrogenation device 中国石油化工股份有限公司 2020-07-07 CN claimed
CN-111375429-B Preparation method of vulcanized hydrogenation catalyst 中国石油化工股份有限公司 2022-10-11 CN disclosed
CN-109926105-B Regeneration method of hydrogenation catalyst 中国石油化工股份有限公司 2021-10-08 CN disclosed
CN-109926100-B Startup method of vulcanized hydrogenation catalyst 中国石油化工股份有限公司 2021-10-08 CN disclosed
CN-109926103-B Regeneration method of deactivated catalyst 中国石油化工股份有限公司 2021-10-08 CN disclosed
CN-109926102-B Hydrogenation catalyst composition and preparation method thereof 中国石油化工股份有限公司 2021-10-08 CN disclosed
CN-109926101-B Startup method of vulcanized catalyst 中国石油化工股份有限公司 2021-10-08 CN disclosed
CN-109926097-B Vulcanization type hydrogenation catalyst composition and preparation method thereof 中国石油化工股份有限公司 2021-10-08 CN disclosed
CN-111378489-B Startup method of hydrogenation device 中国石油化工股份有限公司 2021-01-05 CN disclosed
CN-111375429-A Preparation method of vulcanization type hydrogenation catalyst 中国石油化工股份有限公司 2020-07-07 CN disclosed
CN-111378489-A Startup method of hydrogenation device 中国石油化工股份有限公司 2020-07-07 CN disclosed