SCHEMBL2559206

SCHEMBL2559206

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 3/20 0.52
MRGPRX4 Q96LA9 7/20 0.50
EGFR P00533 7/20 0.48
ERBB2 P04626 7/20 0.48
PTPN7 P35236 1/20 0.45
PTPN12 Q05209 1/20 0.45
PTPN22 Q9Y2R2 1/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
MITF O75030 1/20 0.45
TP53 P04637 1/20 0.45
HPGD P15428 1/20 0.45
XBP1 P17861 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45
NFKB2 Q00653 1/20 0.45
KMT2A Q03164 1/20 0.45
RELA Q04206 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ERBB3 P21860 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
SCHEMBL2560722 0.86 ENPP2 (0.47) ENPP2MRGPRX4MEN1KMT2A
SCHEMBL2554070 0.86 MRGPRX4 (0.68) ENPP2MRGPRX4NPC1TP53HPGD
SCHEMBL2557998 0.86 NPC1 (0.59) ENPP2MRGPRX4MEN1NPC1MITF
SCHEMBL2560162 0.85 ENPP2 (0.56) ENPP2MRGPRX4NPC1HPGDNFKB1
SCHEMBL2558808 0.84 MRGPRX4 (0.63) ENPP2MRGPRX4EGFRERBB2NPC1
SCHEMBL12260343 0.82 ENPP2 (0.63) ENPP2MRGPRX4NPC1HPGDNFKB1
SCHEMBL2560774 0.82 MRGPRX4 (0.60) ENPP2MRGPRX4MEN1NPC1MITF
SCHEMBL257576 0.81 ENPP2 (0.62) ENPP2MRGPRX4NPC1TP53HPGD
SCHEMBL22874527 0.80 EGFR (0.55) MRGPRX4EGFRERBB2PTPN7PTPN12
SCHEMBL410222 0.79 NPC1 (0.56) MRGPRX4EGFRERBB2MEN1NPC1

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