SCHEMBL17328013

SCHEMBL17328013

C=C(C)Oc1cccc2cc3c(c(OC(C)=O)c2c1=O)OC(C)(COC)O3

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ GAA P10253 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ APEX1 P27695 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ BLM P54132 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ ADORA2A P29274 4/20 0.32
▸ ADORA3 P0DMS8 2/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ TXNRD1 Q16881 1/20 0.31
▸ TXNRD3 Q86VQ6 1/20 0.31
▸ TXNRD2 Q9NNW7 1/20 0.31
▸ MEN1 O00255 2/20 0.31

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
SCHEMBL17328220 0.94 MAPT (0.55) MAPTKMT2AALDH1A1GAAL3MBTL1
SCHEMBL12171192 0.83 MAPT (0.48) MAPTKMT2AALDH1A1GAAL3MBTL1
SCHEMBL15887744 0.77 MAPT (0.55) MAPTKMT2AALDH1A1GAAL3MBTL1
SCHEMBL12171206 0.73 MAPT (0.87) MAPTKMT2AALDH1A1GAAL3MBTL1
SCHEMBL12171250 0.67 MAPT (1.00) MAPTKMT2AALDH1A1GAAL3MBTL1
SCHEMBL12171191 0.67 MAPT (0.46) MAPTKMT2AALDH1A1GAAL3MBTL1
SCHEMBL12171171 0.63 MAPT (0.58) MAPTKMT2AALDH1A1GAAL3MBTL1
SCHEMBL15560234 0.63 MAPT (0.79) MAPTKMT2AALDH1A1GAAL3MBTL1
SCHEMBL12171193 0.62 MAPT (0.68) MAPTKMT2AALDH1A1GAAL3MBTL1
Triacetoxyanthrene SCHEMBL9119527 0.60 ALDH1A1 (0.65) MAPTKMT2AALDH1A1GAAL3MBTL1

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-9663442-B2 Stabilization of household, body-care and food products by using benzotropolone containing plant extracts and/or related benzotropolone derivatives BASF SE (DE) 2017-05-30 — — US disclosed
US-20150353470-A1 STABILIZATION OF HOUSEHOLD, BODY-CARE AND FOOD PRODUCTS BY USING BENZOTROPOLONE CONTAINING PLANT EXTRACTS AND/OR RELATED BENZOTROPOLONE DERIVATIVES BASF SE (DE) 2015-12-10 — — 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-20150353470-A1 STABILIZATION OF HOUSEHOLD, BODY-CARE AND FOOD PRODUCTS BY USING BENZOTROPOLONE CONTAINING PLANT EXTRACTS AND/OR RELATED BENZOTROPOLONE DERIVATIVES CBR3, CBR1, CYP8B1 MAPT 2953/4885KMT2A 3226/4885ALDH1A1 2862/4885

“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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