SCHEMBL24788182

SCHEMBL24788182

O=c1ccc2cc3c(cc2o1)CC=C3

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA9 Q16790 10/20 0.47
▸ CA12 O43570 9/20 0.47
▸ MCL1 Q07820 6/20 0.47
▸ HSD17B10 Q99714 6/20 0.47
▸ ALDH1A1 P00352 6/20 0.47
▸ KDM4E B2RXH2 5/20 0.47
▸ HPGD P15428 5/20 0.47
▸ ACHE P22303 5/20 0.47
▸ GAA P10253 4/20 0.47
▸ AKR1B1 P15121 4/20 0.47
▸ MAPT P10636 3/20 0.47
▸ CYP3A4 P08684 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ CYP1A2 P05177 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ GLA P06280 2/20 0.47
▸ CASP1 P29466 2/20 0.47
▸ CASP7 P55210 2/20 0.47
▸ ERAP1 Q9NZ08 2/20 0.47
▸ ALOX15 P16050 2/20 0.47

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
SCHEMBL9464450 0.74 KDM4E (0.54) CA9CA12MCL1HSD17B10ALDH1A1
Coumarin SCHEMBL7633181 0.74 CA12 (0.62) CA9CA12MCL1HSD17B10ALDH1A1
SCHEMBL23303231 0.71 GAA (0.47) CA9CA12MCL1HSD17B10ALDH1A1
SCHEMBL17037877 0.70 CA9 (0.41) CA9CA12MCL1HSD17B10ALDH1A1
SCHEMBL5579338 0.68 KDM4E (0.50) CA9CA12MCL1HSD17B10ALDH1A1
SCHEMBL23845864 0.67 GAA (0.38) CA9CA12MCL1HSD17B10ALDH1A1
SCHEMBL12608748 0.67 MAOA (0.55) HSD17B10ALDH1A1KDM4EHPGDMAPT
SCHEMBL5539713 0.66 CA12 (0.61) CA9CA12MCL1HSD17B10ALDH1A1
SCHEMBL395756 0.66 MEN1 (0.40) CA9HSD17B10ALDH1A1CYP3A4CYP1A2
SCHEMBL9442055 0.66 CA1 (0.31) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220401379-A1 BAKUCHIOL COMPOSITIONS FOR TREATMENT OF POST INFLAMMATORY HYPERPIGMENTATION UNIGEN, INC. (US) 2022-12-22 — — 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-20220401379-A1 BAKUCHIOL COMPOSITIONS FOR TREATMENT OF POST INFLAMMATORY HYPERPIGMENTATION CFH, MPO, TYR CA9 3247/4885CA12 4742/4885MCL1 1490/4885

“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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