SCHEMBL7404148

SCHEMBL7404148

CCc1cccc(B(O)O)c1.[Li]CCCC

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPL P06858 8/20 0.64
LIPG Q9Y5X9 8/20 0.64
ENPP2 Q13822 6/20 0.51
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MGLL Q99685 2/20 0.40
TRPV1 Q8NER1 1/20 0.40
PCSK9 Q8NBP7 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL692342 0.86 ENPP2 (0.67) LPLLIPGENPP2MGLLKDM4E
SCHEMBL3132606 0.81 ENPP2 (0.56) LPLLIPGENPP2CA2MGLL
SCHEMBL3138179 0.80 LPL (0.90) LPLLIPGENPP2CA1CA2
SCHEMBL8143762 0.78 S1PR1 (0.41) LPLLIPGENPP2
SCHEMBL1997891 0.78 LIPG (1.00) LPLLIPGENPP2CA1CA2
SCHEMBL28980699 0.77 LIPG (1.00) LPLLIPGENPP2CA1CA2
SCHEMBL28980689 0.77 LIPG (1.00) LPLLIPGENPP2CA1CA2
SCHEMBL28980712 0.77 LIPG (1.00) LPLLIPGENPP2CA1CA2
SCHEMBL28980647 0.77 LIPG (1.00) LPLLIPGENPP2CA1CA2
SCHEMBL3146386 0.77 LIPG (1.00) LPLLIPGENPP2CA1CA2

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
EP-1036062-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS Pfizer Limited (GB) 2000-09-20 EP disclosed
WO-1999029667-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LIMITED (GB) 1999-06-17 WO disclosed