SCHEMBL28447277

SCHEMBL28447277

NC(CCC(=O)O)C(=O)Nc1ccccc1B(O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 5/20 0.49
▸ DPP4 P27487 2/20 0.48
▸ DPP9 Q86TI2 2/20 0.48
▸ DPP8 Q6V1X1 1/20 0.48
▸ S1PR1 P21453 1/20 0.44
▸ S1PR3 Q99500 1/20 0.44
▸ LNPEP Q9UIQ6 3/20 0.40
▸ ERAP2 Q6P179 1/20 0.40
▸ SLC15A1 P46059 1/20 0.40
▸ ITGB3 P05106 1/20 0.40
▸ ITGAV P06756 1/20 0.40
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ GRM8 O00222 1/20 0.39
▸ GRM6 O15303 1/20 0.39
▸ GRIN2D O15399 1/20 0.39
▸ GRIN3B O60391 1/20 0.39
▸ GSR P00390 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ GRIK1 P39086 1/20 0.39

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
SCHEMBL10362865 0.78 TSHR (0.55) LTA4HLNPEPERAP2CYP1A2L3MBTL1
SCHEMBL11341261 0.78 KDM4E (0.54) LTA4HCYP1A2HDAC3HDAC4HDAC1
SCHEMBL20243040 0.77 LTA4H (0.68) LTA4HS1PR1S1PR3SLC15A1L3MBTL1
SCHEMBL2522626 0.77 LTA4H (0.68) LTA4HS1PR1S1PR3SLC15A1L3MBTL1
SCHEMBL176836 0.76 NPC1 (0.51) LTA4HS1PR1S1PR3
SCHEMBL176835 0.76 NPC1 (0.51) LTA4HS1PR1S1PR3
SCHEMBL16237570 0.74 MDM4 (0.62) L3MBTL1LMNA
SCHEMBL25387355 0.74 L3MBTL1 (0.54) LTA4HL3MBTL1LMNABLM
SCHEMBL25387353 0.74 L3MBTL1 (0.54) LTA4HL3MBTL1LMNABLM
SCHEMBL3149525 0.71 RAB9A (0.45) ITGB3ITGAV

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-111529750-A Bionic skin capable of monitoring and promoting wound healing in real time and preparation method and application thereof 天津大学 2020-08-14 — — CN claimed
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