SCHEMBL2987347

SCHEMBL2987347

CC[C](OCCO)OCCO

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
TSHR P16473 3/20 0.38
MAPK1 P28482 1/20 0.37
ACHE P22303 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 1/20 0.33
NR1I2 O75469 1/20 0.32

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
SCHEMBL7831600 0.78 HCAR2 (0.37) ALDH1A1TSHR
SCHEMBL9720411 0.73 ALDH1A1 (0.52) ALDH1A1TSHRMAPK1ACHE
SCHEMBL874662 0.71 SOAT1 (0.38) ALDH1A1TSHRMAPT
SCHEMBL213301 0.71
SCHEMBL29507152 0.71 ALDH1A1 (0.39) ALDH1A1TSHRMAPK1ACHEMEN1
SCHEMBL7865879 0.71
SCHEMBL25093 0.69
SCHEMBL6185868 0.69 ALDH1A1 (0.48) ALDH1A1TSHRMAPK1ACHE
Water SCHEMBL3266129 0.69
SCHEMBL26143 0.69 NAAA (0.60) ALDH1A1TSHRACHEMEN1KMT2A

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-20100172852-A1 COSMETIC COMPOSITION COMPRISING AN EXTRACT OF CHINESE INSECT WAX CHANEL PARFUMS BEAUTE (FR) 2010-07-08 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-20100172852-A1 COSMETIC COMPOSITION COMPRISING AN EXTRACT OF CHINESE INSECT WAX CUTA, KRT18, LNPK ALDH1A1 4675/4885TSHR 3808/4885MAPK1 2778/4885

“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.