SCHEMBL22855366

SCHEMBL22855366

CC(C)(NC(=O)C(C)(C)C(C)(C)C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.42
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 1/20 0.31
NAALAD2 Q9Y3Q0 1/20 0.30
AR P10275 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL14040406 0.79 KDM4C (0.45) KDM4CALDH1A1TSHRMAPTNAALAD2
SCHEMBL8962258 0.76 EPHX1 (0.37)
SCHEMBL14384504 0.75 KDM4C (0.42) KDM4CALDH1A1TSHRMAPTNAALAD2
SCHEMBL4355408 0.75 KDM4C (0.42) KDM4CALDH1A1TSHRMAPTNAALAD2
SCHEMBL11739867 0.75 ALDH1A1 (0.43) KDM4CALDH1A1TSHRMAPTNAALAD2
SCHEMBL30066024 0.75 KDM4C (0.42) KDM4CALDH1A1TSHRMAPTNAALAD2
SCHEMBL4463196 0.75 KDM4C (0.42) KDM4CALDH1A1TSHRMAPTNAALAD2
SCHEMBL6704123 0.75 KDM4C (0.42) KDM4CALDH1A1TSHRMAPTNAALAD2
Hydrochloric Acid SCHEMBL4469009 0.73 KDM4C (0.41) KDM4CALDH1A1TSHRMAPTAR
SCHEMBL30265312 0.73 KDM4C (0.41) KDM4CALDH1A1TSHRMAPT

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-20200405601-A1 EMULSION COSMETIC SHISEIDO COMPANY, LTD. (JP) 2020-12-31 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-20200405601-A1 EMULSION COSMETIC CUTA, H1-0, XPA KDM4C 1457/4885ALDH1A1 2742/4885TSHR 3335/4885

“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.