SCHEMBL29530873

SCHEMBL29530873

Cc1cccc(C(=O)c2ccccc2C)c1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.72
KCNK3 O14649 1/20 0.59
KCNK9 Q9NPC2 1/20 0.59
PARP1 P09874 1/20 0.53
ALDH1A1 P00352 4/20 0.53
HTT P42858 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HPGD P15428 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MAPK13 O15264 1/20 0.49
MAPK12 P53778 1/20 0.49
MAPK11 Q15759 1/20 0.49
MAPK14 Q16539 1/20 0.49

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
SCHEMBL11612584 1.00 POLB (0.72) POLBKCNK3KCNK9PARP1ALDH1A1
SCHEMBL8549974 0.90 POLB (0.58) POLBKCNK3KCNK9ALDH1A1HTT
SCHEMBL27863588 0.88 POLB (0.61) POLBKCNK3KCNK9ALDH1A1HTT
SCHEMBL21636267 0.85 POLB (0.62) POLBKCNK3KCNK9PARP1HTT
SCHEMBL5151393 0.84 POLB (0.61) POLBKCNK3KCNK9PARP1ALDH1A1
SCHEMBL256846 0.84 POLB (0.61) POLBKCNK3KCNK9PARP1HTT
SCHEMBL3357813 0.84 POLB (0.70) POLBPARP1ALDH1A1HTTSMN1; SMN2
SCHEMBL3362089 0.84 HSD17B1 (0.54) POLBPARP1ALDH1A1HTTNPC1
SCHEMBL30605828 0.84 POLB (0.60) POLBKCNK3KCNK9ALDH1A1HTT
SCHEMBL8611491 0.84 POLB (1.00) POLBPARP1ALDH1A1SMN1; SMN2KMT2A

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-114479735-A Cationic UV curing adhesive and preparation method and application thereof 张河远 2022-05-13 CN disclosed