SCHEMBL31574446

SCHEMBL31574446

Cc1cc(C(=O)Oc2cc(OC(=O)c3ccc(O)cc3)cc(OC(=O)c3ccc(O)c(C)c3)c2)ccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.46
CA1 P00915 5/20 0.46
CA2 P00918 5/20 0.46
CA7 P43166 5/20 0.46
CA9 Q16790 5/20 0.46
CA14 Q9ULX7 5/20 0.46
ESR1 P03372 3/20 0.46
ESR2 Q92731 2/20 0.46
KMT2A Q03164 6/20 0.46
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NR1H4 Q96RI1 2/20 0.43
DYRK1A Q13627 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
SENP1 Q9P0U3 1/20 0.42
CYP1A2 P05177 3/20 0.42
CYP2C9 P11712 3/20 0.42
XDH P47989 1/20 0.42
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 2/20 0.41

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
SCHEMBL31574453 1.00 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL31574434 0.93 KMT2A (0.50) CA12CA1CA2CA7CA9
SCHEMBL767642 0.92 KMT2A (0.50) CA12CA1CA2CA7CA9
SCHEMBL767555 0.89 NR1H4 (0.55) CA12CA1CA2CA7CA9
SCHEMBL767373 0.85 NR1H4 (0.54) CA12CA1CA2CA7CA9
SCHEMBL767927 0.84 NR1H4 (0.51) CA12CA1CA2CA7CA9
SCHEMBL9967349 0.84 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL777986 0.81 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL767659 0.80 KMT2A (0.59) ESR1ESR2KMT2ANR1H4DYRK1A
SCHEMBL11031812 0.80 CA1 (0.57) CA12CA1CA2CA7CA9

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
CN-120019086-A Vinyl compound, vinyl composition, cured vinyl resin, prepreg, resin-coated film, resin-coated metal foil, metal-clad laminate, and printed wiring board 住友化学株式会社 2025-05-16 CN disclosed