SCHEMBL28982525

SCHEMBL28982525

CC(N)P(=O)(OC1CCCCC1)OC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.51
ACHE P22303 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.42
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
ANPEP P15144 2/20 0.35
ERAP2 Q6P179 2/20 0.35
METAP1 P53582 1/20 0.32
FDPS P14324 1/20 0.32
CA12 O43570 2/20 0.32
MMP2 P08253 2/20 0.32
CA9 Q16790 2/20 0.32

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
SCHEMBL13711672 0.82 NPSR1 (0.50) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL12076280 0.81 NPSR1 (0.58) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL28982526 0.80 NPSR1 (0.43) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL28674351 0.77 NPSR1 (0.41) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL9614567 0.76 NPSR1 (0.47) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL4454142 0.76 NPSR1 (0.53) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL10831669 0.76 NPSR1 (0.53) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL13712901 0.75 NPSR1 (0.45) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL9614631 0.75 ACHE (0.43) NPSR1ACHEMEN1KMT2AGAA
SCHEMBL3070641 0.74 ACHE (0.48) NPSR1ACHEMEN1KMT2AGAA

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-113801254-B Polypropylene catalyst and preparation method thereof 中国石油天然气股份有限公司 2023-04-07 CN disclosed