SCHEMBL2555065

SCHEMBL2555065

CCc1ccc(OCc2cccc(B(O)O)c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.71
LPL P06858 3/20 0.49
LIPG Q9Y5X9 3/20 0.49
MAOB P27338 8/20 0.48
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
TP53 P04637 2/20 0.47
PKM P14618 2/20 0.47
NFKB1 P19838 2/20 0.47
NFKB2 Q00653 2/20 0.47
RELA Q04206 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MRGPRX4 Q96LA9 2/20 0.47
RAB9A P51151 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
F2 P00734 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
SCHEMBL2555516 0.88 ENPP2 (0.59) ENPP2LPLLIPGMAOBSMN1; SMN2
SCHEMBL15331009 0.88 ENPP2 (0.74) ENPP2MAOBTP53PKMNFKB1
SCHEMBL16687434 0.86 ENPP2 (0.68) ENPP2LPLLIPGMAOBTP53
SCHEMBL30688670 0.84 ENPP2 (0.65) ENPP2MAOBTP53PKMNFKB1
SCHEMBL29138052 0.84 ENPP2 (0.65) ENPP2MAOBTP53PKMNFKB1
SCHEMBL2561245 0.83 ENPP2 (0.64) ENPP2MAOBRXRARXRBSMN1; SMN2
SCHEMBL9893590 0.83 ENPP2 (1.00) ENPP2LPLLIPGMAOBTP53
SCHEMBL2555997 0.83 ENPP2 (0.64) ENPP2LPLLIPGTP53PKM
SCHEMBL21234312 0.82 ENPP2 (0.64) ENPP2LPLLIPGMAOBRXRA
SCHEMBL1526395 0.82 ENPP2 (0.64) ENPP2MAOBMRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed