SCHEMBL29098300

SCHEMBL29098300

CC(=O)OC1CN(C(=O)O)Cc2ccc(Cl)nc21

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 1/20 0.39
HRH4 Q9H3N8 1/20 0.31
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NOTUM Q6P988 1/20 0.30
CHRM4 P08173 1/20 0.30
DRD2 P14416 1/20 0.30
HTR7 P34969 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
SCHEMBL29781230 0.84 ESR2 (0.43) ABHD6POLB
SCHEMBL29098314 0.82 ABHD6 (0.38) ABHD6HRH4POLBTDP1L3MBTL1
SCHEMBL29098317 0.81 ABHD6 (0.40) ABHD6
SCHEMBL29098305 0.78 ABHD6 (0.39) ABHD6HRH4POLBTDP1L3MBTL1
SCHEMBL3955281 0.77 CHRM4 (0.40) ABHD6CHRM4DRD2HTR7
SCHEMBL29264434 0.77 ABHD6 (0.38) ABHD6HRH4POLBTDP1L3MBTL1
SCHEMBL14885005 0.75 HDAC1 (0.42) ABHD6CHRM4DRD2HTR7
SCHEMBL30694265 0.75 HDAC1 (0.42) ABHD6CHRM4DRD2HTR7
SCHEMBL10286040 0.75 HDAC1 (0.42) ABHD6CHRM4DRD2HTR7
SCHEMBL29264405 0.72 KMT2A (0.39) ABHD6L3MBTL1DRD2

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
CN-116848122-A Plasmin inhibitor, preparation method and application thereof 赛诺哈勃药业(成都)有限公司 2023-10-03 CN disclosed
CN-116710440-A Plasmin inhibitor, preparation method and application thereof 赛诺哈勃药业(成都)有限公司 2023-09-05 CN disclosed