SCHEMBL2556022

SCHEMBL2556022

OB(O)c1ccc(COc2cc(Cl)ccc2Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.51
HDAC8 Q9BY41 1/20 0.51
ENPP2 Q13822 3/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
TP53 P04637 2/20 0.46
HPGD P15428 2/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
EGFR P00533 1/20 0.43
SLC6A4 P31645 2/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL2558867 0.88 MRGPRX4 (0.62) MRGPRX4ENPP2SMN1; SMN2HPGDKMT2A
SCHEMBL2560524 0.85 ENPP2 (0.52) MRGPRX4HDAC8ENPP2SMN1; SMN2HPGD
SCHEMBL13321696 0.85 HDAC8 (0.60) MRGPRX4HDAC8SMN1; SMN2TP53HPGD
SCHEMBL2555006 0.84 MRGPRX4 (0.61) MRGPRX4ENPP2SMN1; SMN2TP53HPGD
SCHEMBL2554749 0.82 MRGPRX4 (0.53) MRGPRX4ENPP2TP53MEN1KMT2A
SCHEMBL9893908 0.81 MRGPRX4 (0.51) MRGPRX4ENPP2
SCHEMBL544428 0.81 LIPE (0.53) MRGPRX4HDAC8ENPP2SMN1; SMN2TP53
SCHEMBL15331520 0.81 HPGD (0.60) ENPP2SMN1; SMN2TP53HPGDLMNA
SCHEMBL913467 0.80 ENPP2 (0.64) MRGPRX4HDAC8ENPP2SMN1; SMN2LMNA
SCHEMBL2844189 0.79 CCR5 (0.55) MRGPRX4HDAC8SMN1; SMN2TP53HPGD

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