SCHEMBL3175203

SCHEMBL3175203

OB(O)c1ccc(N(c2ccc(B(O)O)cc2)c2ccc(B(O)O)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 5/20 0.55
CA2 P00918 6/20 0.52
CA1 P00915 5/20 0.52
LPL P06858 4/20 0.52
LIPG Q9Y5X9 4/20 0.52
TSHR P16473 1/20 0.52
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
MGLL Q99685 2/20 0.48
KDM4E B2RXH2 1/20 0.46
F11 P03951 1/20 0.44

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
SCHEMBL23966 0.89 ENPP2 (0.62) ENPP2CA2CA1LPLLIPG
SCHEMBL4234167 0.89 ENPP2 (0.62) ENPP2CA2CA1LPLLIPG
SCHEMBL13806989 0.87 ORAI1 (0.54) ENPP2CA2CA1LPLLIPG
SCHEMBL31606744 0.87 CA2 (0.76) ENPP2CA2CA1LPLLIPG
SCHEMBL2309007 0.87 LPL (0.76) ENPP2CA2CA1LPLLIPG
SCHEMBL31606749 0.87 ENPP2 (0.44) ENPP2CA2CA1LPLLIPG
SCHEMBL14059717 0.87 ENPP2 (0.76) ENPP2CA2CA1LPLLIPG
SCHEMBL19733178 0.83 CA2 (0.71) ENPP2CA2CA1LPLLIPG
SCHEMBL17731991 0.83 CA2 (0.71) ENPP2CA2CA1LPLLIPG
SCHEMBL18540460 0.83 CA2 (0.71) ENPP2CA2CA1LPLLIPG

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11027257-B2 Polycalixarene materials, methods of making same, and uses thereof NEW YORK UNIVERSITY IN ABU DHABI CORPORATION (AE) 2021-06-08 US disclosed
US-20190015814-A1 POLYCALIXARENE MATERIALS, METHODS OF MAKING SAME, AND USES THEREOF NEW YORK UNIVERSITY IN ABU DHABI CORPORATION (AE) 2019-01-17 US disclosed
WO-2016191816-A1 GLUCOSE SENSITIVE PHENYLBORATE ACID CAPSULES FOR INSULIN DELIVERY THE UNIVERSITY OF MELBOURNE (AU) 2016-12-08 WO disclosed
US-7659009-B2 Thermally crosslinkable materials and multi-layered devices therefrom NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2010-02-09 US disclosed
US-7659009-B2 Thermally crosslinkable materials and multi-layered devices therefrom NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2010-02-09 US disclosed
WO-2009127896-A1 SYNTHESIS OF AN ORDERED COVALENT MONOLAYER NETWORK ONTO A SURFACE UNIVERSITE D'AIX-MARSEILLE I (FR) 2009-10-22 WO disclosed
US-20060166035-A1 Thermally crosslinkable materials and multi-layered devices therefrom NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2006-07-27 US disclosed
WO-2004041962-A2 THERMALLY CROSSLINKABLE MATERIALS AND MULTI-LAYERED DEVICES THEREFROM NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2004-05-21 WO disclosed