SCHEMBL2554070

SCHEMBL2554070

OB(O)c1cccc(COc2ccc(Cl)cc2Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 12/20 0.68
ENPP2 Q13822 4/20 0.55
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
MAPT P10636 2/20 0.51
HTT P42858 2/20 0.51
HPGD P15428 1/20 0.51
MDM2 Q00987 1/20 0.51
GPR55 Q9Y2T6 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
TP53 P04637 1/20 0.46
XBP1 P17861 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL2555006 0.89 MRGPRX4 (0.61) MRGPRX4ENPP2NPC1RAB9ASMN1; SMN2
SCHEMBL257576 0.89 ENPP2 (0.62) MRGPRX4ENPP2NPC1RAB9ASMN1; SMN2
SCHEMBL2559560 0.86 MRGPRX4 (0.63) MRGPRX4ENPP2SMN1; SMN2
SCHEMBL2559206 0.86 ENPP2 (0.52) MRGPRX4ENPP2NPC1RAB9ASMN1; SMN2
SCHEMBL2558808 0.86 MRGPRX4 (0.63) MRGPRX4ENPP2NPC1RAB9ASMN1; SMN2
SCHEMBL2557998 0.85 NPC1 (0.59) MRGPRX4ENPP2NPC1RAB9ASMN1; SMN2
SCHEMBL2558867 0.84 MRGPRX4 (0.62) MRGPRX4ENPP2NPC1RAB9ASMN1; SMN2
SCHEMBL2560774 0.81 MRGPRX4 (0.60) MRGPRX4ENPP2NPC1RAB9ASMN1; SMN2
SCHEMBL29952431 0.81 ENPP2 (0.66) MRGPRX4ENPP2NPC1RAB9ASMN1; SMN2
SCHEMBL22480615 0.81 MRGPRX4 (1.00) MRGPRX4NPC1RAB9ASMN1; SMN2ALDH1A1

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