SCHEMBL6820583

SCHEMBL6820583

O=C1C(=C(C2CC2)C2CC2)Oc2cccc(O)c21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.44
MAPT P10636 4/20 0.39
TSHR P16473 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 2/20 0.39
USP2 O75604 2/20 0.39
HPN P05981 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX5 P09917 1/20 0.39
THRB P10828 1/20 0.39
PTGS1 P23219 1/20 0.39
PDE4A P27815 1/20 0.39
KDR P35968 1/20 0.39
SIRT5 Q9NXA8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL6823698 0.85 TYR (0.43) TYRMAPTTSHRKMT2AALDH1A1
SCHEMBL6421978 0.77 TYR (0.49) TYRMAPTTSHRKMT2AALDH1A1
SCHEMBL6919628 0.73 TYR (0.46) TYRMAPTTSHRKMT2AALDH1A1
SCHEMBL6820551 0.73 TYR (0.46) TYRMAPTTSHRKMT2AALDH1A1
SCHEMBL6424903 0.71 TYR (0.43) TYRMAPTTSHRKMT2AALDH1A1
SCHEMBL14008639 0.69 TYR (0.51) TYRMAPTTSHRKMT2AALDH1A1
SCHEMBL14008598 0.68 TYR (0.50) TYRMAPTTSHRKMT2AALDH1A1
SCHEMBL6823700 0.68 TYR (0.53) TYRPIK3CAMTOR
SCHEMBL6424333 0.67 TYR (0.46) TYRMAPTTSHRKMT2AALDH1A1
SCHEMBL6424546 0.66 TYR (0.44) TYRMAPTTSHRKMT2AALDH1A1

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
WO-2004076444-A2 NOVEL HYDROXYCOUMARANONE DERIVATIVES AS ANTITUMOR AND ANTIMETASTATIC F. HOFFMANN-LA ROCHE AG (CH) 2004-09-10 WO disclosed