SCHEMBL8746642

SCHEMBL8746642

O=C(O)C=Cc1cccc(C=CC(=O)O)c1C=CC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
NFKB1 P19838 1/20 0.61
CA4 P22748 1/20 0.61
KDM4E B2RXH2 2/20 0.53
HCAR2 Q8TDS4 3/20 0.52
HDAC3 O15379 1/20 0.52
TNKS O95271 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
TNKS2 Q9H2K2 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
HDAC5 Q9UQL6 1/20 0.52
HTT P42858 1/20 0.52

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
SCHEMBL8746640 1.00 CA1 (0.61) CA1CA2NFKB1CA4KDM4E
SCHEMBL3423203 0.88 NFKB1 (0.69) CA1CA2NFKB1CA4KDM4E
SCHEMBL10873107 0.88 CA1 (0.48) CA1CA2NFKB1CA4KDM4E
SCHEMBL4543959 0.88 NFKB1 (0.69) CA1CA2NFKB1CA4KDM4E
SCHEMBL69543 0.83 NFKB1 (0.75) CA1CA2NFKB1CA4KDM4E
SCHEMBL31197561 0.83 NFKB1 (0.75) CA1CA2NFKB1CA4KDM4E
SCHEMBL459291 0.83 NFKB1 (0.75) CA1CA2NFKB1CA4KDM4E
SCHEMBL2303374 0.83 CA1 (0.53) CA1CA2NFKB1CA4KDM4E
SCHEMBL8746633 0.83 CA1 (0.57) CA1CA2NFKB1CA4KDM4E
SCHEMBL2819645 0.82 CA1 (0.52) CA1CA2NFKB1CA4KDM4E

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
EP-0644232-B1 Free radical cured rubber GOODYEAR TIRE & RUBBER (US) 1997-03-05 EP claimed
CN-110178083-B Photosensitive coloring composition, cured product, coloring spacer and image display device 三菱化学株式会社 2023-03-24 CN disclosed