SCHEMBL237159

SCHEMBL237159

NCCNCc1ccccc1B(O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47
CA12 O43570 5/20 0.46
CA2 P00918 5/20 0.46
CA9 Q16790 4/20 0.46
KDM4E B2RXH2 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CHRM2 P08172 4/20 0.45
SCN8A Q9UQD0 1/20 0.43
MPO P05164 4/20 0.42
SLC6A4 P31645 2/20 0.42
MC4R P32245 1/20 0.41
MC5R P33032 1/20 0.41
GRIN1 Q05586 2/20 0.40
GRIN2A Q12879 2/20 0.40

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
SCHEMBL1700582 0.92 CHRM2 (0.56) CA12CA2CA9KDM4ETSHR
SCHEMBL30253962 0.92 CHRM2 (0.56) CA12CA2CA9KDM4ETSHR
SCHEMBL15745843 0.89 CA12 (0.58) LIPGCA12CA2CA9KDM4E
SCHEMBL15745844 0.89 CA12 (0.58) LIPGCA12CA2CA9KDM4E
SCHEMBL6348034 0.86 LIPG (0.56) LIPGCA12CA2CA9KDM4E
SCHEMBL26009770 0.85 LIPG (0.50) LIPGCA12CA2CA9KDM4E
SCHEMBL13287109 0.81 LIPG (0.48) LIPGCA12CA2CA9KDM4E
SCHEMBL18575559 0.80 CA12 (0.54) CA12CA2CA9KDM4ETSHR
SCHEMBL6352960 0.80 MPO (0.65) LIPGMPOSLC6A4
SCHEMBL17539677 0.79 LIPG (0.52) LIPGCA12CA2CA9KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8708045-B2 Multifunctional boronic acid crosslinking agents and associated methods HALLIBURTON ENERGY SERVICES, INC. (US) 2014-04-29 US disclosed
US-8708045-B2 Multifunctional boronic acid crosslinking agents and associated methods HALLIBURTON ENERGY SERVICES, INC. (US) 2014-04-29 US disclosed
US-8708045-B2 Multifunctional boronic acid crosslinking agents and associated methods HALLIBURTON ENERGY SERVICES, INC. (US) 2014-04-29 US disclosed
EP-2598597-A1 MULTIFUNCTIONAL BORONIC ACID CROSSLINKING AGENTS AND ASSOCIATED METHODS Halliburton Energy Services, Inc. (US) 2013-06-05 EP disclosed
EP-2588559-A1 MULTIFUNCTIONAL BORONIC CROSSLINKERS AND ASSOCIATED METHODS Halliburton Energy Services, Inc. (US) 2013-05-08 EP disclosed
US-8424603-B2 Multifunctional boronic crosslinkers and associated methods HALLIBURTON ENERGY SERVICES, INC. (US) 2013-04-23 US disclosed
US-8424603-B2 Multifunctional boronic crosslinkers and associated methods HALLIBURTON ENERGY SERVICES, INC. (US) 2013-04-23 US disclosed
US-8424603-B2 Multifunctional boronic crosslinkers and associated methods HALLIBURTON ENERGY SERVICES, INC. (US) 2013-04-23 US disclosed
WO-2013039620-A1 MULTIFUNCTIONAL BORONIC ACID CROSSLINKING AGENTS AND ASSOCIATED METHODS HALLIBURTON ENERGY SERVICES, INC. (US) 2013-03-21 WO disclosed
WO-2013039620-A1 MULTIFUNCTIONAL BORONIC ACID CROSSLINKING AGENTS AND ASSOCIATED METHODS HALLIBURTON ENERGY SERVICES, INC. (US) 2013-03-21 WO disclosed
US-20120004148-A1 Multifunctional Boronic Acid Crosslinking Agents and Associated Methods HALLIBURTON ENERGY SERVICES, INC. (US) 2012-01-05 US disclosed
US-20120004148-A1 Multifunctional Boronic Acid Crosslinking Agents and Associated Methods HALLIBURTON ENERGY SERVICES, INC. (US) 2012-01-05 US disclosed
US-20120004148-A1 Multifunctional Boronic Acid Crosslinking Agents and Associated Methods HALLIBURTON ENERGY SERVICES, INC. (US) 2012-01-05 US disclosed
US-20120000659-A1 Multifunctional Boronic Crosslinkers and Associated Methods HALLIBURTON ENERGY SERVICES, INC. 2012-01-05 US disclosed
US-20120000659-A1 Multifunctional Boronic Crosslinkers and Associated Methods HALLIBURTON ENERGY SERVICES, INC. 2012-01-05 US disclosed
US-20120000659-A1 Multifunctional Boronic Crosslinkers and Associated Methods HALLIBURTON ENERGY SERVICES, INC. 2012-01-05 US disclosed
WO-2012001363-A1 MULTIFUNCTIONAL BORONIC CROSSLINKERS AND ASSOCIATED METHODS HALLIBURTON ENERGY SERVICES, INC. (US) 2012-01-05 WO disclosed
WO-2012001363-A1 MULTIFUNCTIONAL BORONIC CROSSLINKERS AND ASSOCIATED METHODS HALLIBURTON ENERGY SERVICES, INC. (US) 2012-01-05 WO disclosed