SCHEMBL14370772

SCHEMBL14370772

CC(=O)Oc1cc2cccc(O)c(=O)c2c(C)c1OC(C)=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.63
▸ GAA P10253 4/20 0.63
▸ KDM4E B2RXH2 3/20 0.63
▸ ALDH1A1 P00352 3/20 0.63
▸ KMT2A Q03164 3/20 0.63
▸ L3MBTL1 Q9Y468 3/20 0.63
▸ POLB P06746 2/20 0.63
▸ APEX1 P27695 2/20 0.63
▸ RECQL P46063 2/20 0.63
▸ BLM P54132 2/20 0.63
▸ TDP1 Q9NUW8 2/20 0.63
▸ TP53 P04637 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ CDK2 P24941 2/20 0.44
▸ INPPL1 O15357 1/20 0.44
▸ NSD2 O96028 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ THRB P10828 1/20 0.44

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
SCHEMBL14370739 0.89 MAPT (0.79) MAPTGAAKDM4EALDH1A1KMT2A
SCHEMBL15555870 0.82 MAPT (0.59) MAPTGAAKDM4EALDH1A1KMT2A
SCHEMBL17069803 0.78 MAPT (0.63) MAPTGAAKDM4EALDH1A1KMT2A
SCHEMBL17069804 0.78 MAPT (0.79) MAPTGAAKDM4EALDH1A1KMT2A
SCHEMBL15560234 0.78 MAPT (0.79) MAPTGAAKDM4EALDH1A1KMT2A
SCHEMBL12171250 0.77 MAPT (1.00) MAPTGAAKDM4EALDH1A1KMT2A
SCHEMBL14370775 0.77 PTPN11 (0.58) MAPTGAAKDM4EALDH1A1KMT2A
Hydrochloric Acid SCHEMBL11281961 0.74 ALDH1A1 (0.51) MAPTGAAKDM4EALDH1A1KMT2A
SCHEMBL12171193 0.74 MAPT (0.68) MAPTGAAKDM4EALDH1A1KMT2A
SCHEMBL12171206 0.72 MAPT (0.87) MAPTGAAKDM4EALDH1A1KMT2A

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-7288680-B2 Benzotropolone derivatives and modulation of inflammatory response WELLGEN, INC. (US) 2007-10-30 — — US disclosed
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