SCHEMBL28802427

SCHEMBL28802427

COC(=O)C1=CCC(O)(O)C=C1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.35
LMNA P02545 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
THRB P10828 1/20 0.35
CHRM1 P11229 1/20 0.35
BLM P54132 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
TSHR P16473 1/20 0.31
CA12 O43570 3/20 0.31
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31
CA7 P43166 3/20 0.31
CA9 Q16790 3/20 0.31
CA14 Q9ULX7 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL31097019 0.84 CHRM3 (0.35) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL28802419 0.81 KDM4E (0.39) LMNATSHRCA12CA1CA2
SCHEMBL28464500 0.77 GAA (0.30)
SCHEMBL27447537 0.76
SCHEMBL8279057 0.73
SCHEMBL28238680 0.73
SCHEMBL16810704 0.72
SCHEMBL27209677 0.69 TSHR (0.39) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL11140208 0.67
SCHEMBL9532663 0.67 CA1 (0.38) CHRM3LMNACHRM2CHRM4CHRM5

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-114805811-A Polyarylether resin containing carboxyl side group, synthesis method and application of polyarylether resin in coating 浙江鹏孚隆新材料有限公司 2022-07-29 CN disclosed