Catechol

Catechol

SCHEMBL28144792

C=CC(=O)NCCC.Oc1ccccc1O

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ZDHHC20 Q5W0Z9 1/20 0.51
▸ ZDHHC2 Q9UIJ5 1/20 0.51
▸ TGM2 P21980 3/20 0.44
▸ NAAA Q02083 1/20 0.43
▸ APP P05067 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ EGFR P00533 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PELI1 Q96FA3 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ EPHX2 P34913 1/20 0.39
▸ BCHE P06276 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
Catechol SCHEMBL28034242 0.86 TGM2 (0.44) ZDHHC20ZDHHC2TGM2NAAAALDH1A1
SCHEMBL141762 0.83 — —
Catechol SCHEMBL28258582 0.81 TGM2 (0.38) ZDHHC20ZDHHC2TGM2NAAAAPP
Water SCHEMBL28252943 0.81 — —
Hydrochloric Acid SCHEMBL15846881 0.81 — —
SCHEMBL9063855 0.81 — —
Ammonia Solution, Strong SCHEMBL27756085 0.81 — —
SCHEMBL28752877 0.81 RAB9A (0.49) ZDHHC20ZDHHC2TGM2GAAALDH1A1
Acetone SCHEMBL28370291 0.79 ZDHHC20 (0.64) ZDHHC20ZDHHC2TGM2GAAALDH1A1
Hydrochloric Acid SCHEMBL15201039 0.79 ZDHHC20 (0.64) ZDHHC20ZDHHC2TGM2GAAALDH1A1

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-106674420-A Coloring material, coloring film, preparation method of coloring film and eye ophthalmic lens 鸿富锦精密工业(深圳)有限公司 2017-05-17 — — CN claimed
CN-106632898-A Spectacle lens material, and spectacle lens and preparation method thereof 鸿富锦精密工业(深圳)有限公司 2017-05-10 — — CN claimed
CN-108976340-A Eye lens and preparation method thereof 鸿富锦精密工业(深圳)有限公司 2018-12-11 — — CN disclosed
CN-108976340-A Eye lens and preparation method thereof 鸿富锦精密工业(深圳)有限公司 2018-12-11 — — CN disclosed
CN-106632898-A Spectacle lens material, and spectacle lens and preparation method thereof 鸿富锦精密工业(深圳)有限公司 2017-05-10 — — CN disclosed
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