SCHEMBL14003928

SCHEMBL14003928

COC(=O)[C@@H](N)CSc1cc(O)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.41
▸ CA1 P00915 4/20 0.41
▸ CA2 P00918 4/20 0.41
▸ CA7 P43166 4/20 0.41
▸ CA9 Q16790 4/20 0.41
▸ CA14 Q9ULX7 4/20 0.41
▸ KIF11 P52732 1/20 0.40
▸ DRD1 P21728 1/20 0.39
▸ ALDH1A1 P00352 7/20 0.39
▸ MAPT P10636 4/20 0.39
▸ KDM4E B2RXH2 4/20 0.39
▸ HPGD P15428 4/20 0.39
▸ HSD17B10 Q99714 4/20 0.39
▸ TP53 P04637 3/20 0.39
▸ ALOX15 P16050 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALOX12 P18054 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 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
SCHEMBL14003922 0.87 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL13805530 0.87 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL14003924 0.83 KIF11 (0.46) KIF11ALDH1A1MAPTKDM4EHPGD
SCHEMBL14003929 0.83 KIF11 (0.46) KIF11ALDH1A1MAPTKDM4EHPGD
SCHEMBL14003930 0.81 RXFP1 (0.43) CA12CA1CA2CA7CA9
SCHEMBL14374020 0.78 KIF11 (0.40) KIF11ALDH1A1MAPTKDM4EHPGD
Hydrochloric Acid SCHEMBL9536911 0.77 ESR1 (0.43) CA12CA1CA2CA7CA9
SCHEMBL14374011 0.73 KIF11 (0.43) KIF11DRD1ALDH1A1MAPTKDM4E
SCHEMBL2069242 0.72 KIF11 (0.47) KIF11ALDH1A1HSD17B10TP53ALOX15
SCHEMBL14003927 0.71 RXFP1 (0.51) ALDH1A1MAPTKDM4EHPGDALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080286219-A1 Hydroquinone derivative skin brightening compounds EASTMAN CHEMICAL COMPANY 2008-11-20 — — US disclosed
US-20080286219-A1 Hydroquinone derivative skin brightening compounds EASTMAN CHEMICAL COMPANY 2008-11-20 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080286219-A1 Hydroquinone derivative skin brightening compounds NQO1, CUTA, TYR CA12 3932/4885CA1 4807/4885CA2 4307/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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