SCHEMBL16932396

SCHEMBL16932396

COc1cc2c(c(OC)c1OC)C(=O)c1c(cc(C)c(OC)c1O)C2=O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 5/20 0.81
▸ ELANE P08246 4/20 0.49
▸ PIM1 P11309 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ ATM Q13315 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MAPT P10636 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ GLA P06280 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ MGAM O43451 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ SI P14410 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
SCHEMBL16226676 0.91 EPHX2 (0.86) EPHX2ELANEPIM1ALDH1A1CYP1A2
Chrysoobtusin SCHEMBL16226057 0.90 EPHX2 (1.00) EPHX2ELANEPIM1ALDH1A1CYP1A2
SCHEMBL31322006 0.88 EPHX2 (1.00) EPHX2ELANEPIM1ALDH1A1CYP1A2
SCHEMBL29396060 0.88 EPHX2 (1.00) EPHX2ELANEPIM1ALDH1A1CYP1A2
SCHEMBL16226754 0.88 EPHX2 (1.00) EPHX2ELANEPIM1ALDH1A1CYP1A2
SCHEMBL31746123 0.87 EPHX2 (0.63) EPHX2ELANEPIM1ALDH1A1MAPT
SCHEMBL29709334 0.87 EPHX2 (0.74) EPHX2ELANEPIM1ALDH1A1CYP1A2
SCHEMBL27927334 0.87 EPHX2 (0.86) EPHX2ELANEPIM1ALDH1A1CYP1A2
SCHEMBL29709367 0.84 EPHX2 (0.70) EPHX2ELANEPIM1ALDH1A1CYP1A2
SCHEMBL3176048 0.82 ELANE (0.71) EPHX2ELANEPIM1ALDH1A1MAPT

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-20170298209-A1 USE OF A QUINONE COMPOUND IN BUILDING MATERIALS ARKION LIFE SCIENCES, LLC (US) 2017-10-19 — — US disclosed
US-20150208657-A1 USE OF QUINONE COMPOUND IN BUILDING MATERIALS ARKION LIFE SCIENCES, LLC (US) 2015-07-30 — — US disclosed
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