SCHEMBL2557998

SCHEMBL2557998

OB(O)c1cccc(COc2ccccc2Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.59
HPGD P15428 4/20 0.59
RAB9A P51151 4/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
MITF O75030 1/20 0.59
TP53 P04637 1/20 0.59
XBP1 P17861 1/20 0.59
NFKB1 P19838 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
ENPP2 Q13822 5/20 0.57
MAPT P10636 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
MRGPRX4 Q96LA9 6/20 0.48
LIPE Q05469 1/20 0.47
KDM4E B2RXH2 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
SCHEMBL2560774 0.90 MRGPRX4 (0.60) NPC1HPGDRAB9ASMN1; SMN2MEN1
SCHEMBL2559206 0.86 ENPP2 (0.52) NPC1HPGDRAB9ASMN1; SMN2MEN1
SCHEMBL2555006 0.85 MRGPRX4 (0.61) NPC1HPGDRAB9ASMN1; SMN2MEN1
SCHEMBL2554070 0.85 MRGPRX4 (0.68) NPC1HPGDRAB9ASMN1; SMN2TP53
SCHEMBL2556973 0.84 ENPP2 (0.51) NPC1HPGDRAB9ASMN1; SMN2MEN1
SCHEMBL2558808 0.83 MRGPRX4 (0.63) NPC1RAB9ASMN1; SMN2TP53XBP1
SCHEMBL2560724 0.83 GPR84 (0.55) NPC1HPGDRAB9ASMN1; SMN2MEN1
SCHEMBL2557342 0.83 MRGPRX4 (0.53) NPC1HPGDRAB9ASMN1; SMN2MEN1
SCHEMBL15331520 0.83 HPGD (0.60) NPC1HPGDRAB9ASMN1; SMN2MEN1
SCHEMBL2557545 0.82 MRGPRX4 (0.59) NPC1RAB9ASMN1; SMN2ENPP2MAPT

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