SCHEMBL2558867

SCHEMBL2558867

OB(O)c1ccc(COc2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 13/20 0.62
ENPP2 Q13822 2/20 0.58
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 3/20 0.50
USP2 O75604 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL2556022 0.88 MRGPRX4 (0.51) MRGPRX4ENPP2NPC1RAB9AHPGD
SCHEMBL2554884 0.85 ENPP2 (0.59) MRGPRX4ENPP2NPC1RAB9AHPGD
SCHEMBL2560162 0.85 ENPP2 (0.56) MRGPRX4ENPP2NPC1RAB9AHPGD
SCHEMBL2554749 0.85 MRGPRX4 (0.53) MRGPRX4ENPP2KMT2A
SCHEMBL13321693 0.85 MRGPRX4 (0.71) MRGPRX4NPC1RAB9APOLBHPGD
SCHEMBL2554070 0.84 MRGPRX4 (0.68) MRGPRX4ENPP2NPC1RAB9AHPGD
SCHEMBL11512939 0.83 MRGPRX4 (0.69) MRGPRX4NPC1RAB9APOLBHPGD
SCHEMBL12260343 0.82 ENPP2 (0.63) MRGPRX4ENPP2NPC1RAB9AHPGD
SCHEMBL8453 0.81 ENPP2 (0.66) MRGPRX4ENPP2NPC1RAB9AHPGD
SCHEMBL29952431 0.81 ENPP2 (0.66) MRGPRX4ENPP2NPC1RAB9AHPGD

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