SCHEMBL13773002

SCHEMBL13773002

COc1cc(C(=O)CC(=O)C(C)(C)C)ccc1OCCC[Si](C)(C)O[Si](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ KMT2A Q03164 5/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ PRSS1 P07477 4/20 0.41
▸ MAPT P10636 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL13773006 0.83 THRA (0.57) THRATHRBKMT2AMEN1MAPT
SCHEMBL9306660 0.82 HPGD (0.55) THRATHRBKMT2AMEN1MAPT
SCHEMBL13773009 0.81 THRA (0.64) THRATHRBPRSS1
SCHEMBL480333 0.80 MAPT (0.57) KMT2AMEN1MAPTSMN1; SMN2CYP1A2
SCHEMBL4141881 0.80 KDM4E (0.53) THRATHRBKMT2AMEN1PRSS1
SCHEMBL13773013 0.80 THRA (0.45) THRATHRBKMT2AMEN1PRSS1
SCHEMBL13773014 0.79 MEN1 (0.38) KMT2AMEN1MAPTSMN1; SMN2CYP1A2
SCHEMBL13773001 0.79 MEN1 (0.39) KMT2AMEN1MAPTSMN1; SMN2CYP1A2
SCHEMBL13773010 0.79 SMPD1 (0.58) THRATHRB
SCHEMBL4144753 0.75 KMT2A (0.52) KMT2AMEN1MAPTSMN1; SMN2CYP1A2

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-20090169494-A1 Sunscreen cosmetic composition SHISEIDO COMPANY LTD (JP) 2009-07-02 — — 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-20090169494-A1 Sunscreen cosmetic composition SUN2, TYR, AHR THRA 2411/4885THRB 2755/4885KMT2A 981/4885

“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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