SCHEMBL2559560

SCHEMBL2559560

Cc1cc(Cl)ccc1OCc1cccc(B(O)O)c1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 11/20 0.63
ENPP2 Q13822 4/20 0.56
FFAR1 O14842 1/20 0.53
FFAR4 Q5NUL3 1/20 0.53
SCN4A P35499 1/20 0.46
ANO1 Q5XXA6 1/20 0.44
THRB P10828 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL2554070 0.86 MRGPRX4 (0.68) MRGPRX4ENPP2SMN1; SMN2
SCHEMBL2556265 0.86 MRGPRX4 (0.61) MRGPRX4ENPP2FFAR1FFAR4
SCHEMBL2554749 0.85 MRGPRX4 (0.53) MRGPRX4ENPP2FFAR1FFAR4SCN4A
SCHEMBL2555006 0.83 MRGPRX4 (0.61) MRGPRX4ENPP2THRBSMN1; SMN2
SCHEMBL2558750 0.83 MRGPRX4 (0.64) MRGPRX4ENPP2FFAR1FFAR4
SCHEMBL6833481 0.82 ENPP2 (0.52) MRGPRX4ENPP2FFAR1FFAR4SMN1; SMN2
SCHEMBL2558808 0.81 MRGPRX4 (0.63) MRGPRX4ENPP2SMN1; SMN2
SCHEMBL13144443 0.79 MRGPRX4 (0.68) MRGPRX4FFAR1FFAR4SCN4A
SCHEMBL2557599 0.79 ENPP2 (0.51) MRGPRX4ENPP2
SCHEMBL2561245 0.79 ENPP2 (0.64) MRGPRX4ENPP2SMN1; SMN2

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