SCHEMBL2560439

SCHEMBL2560439

O=C(Nc1ccc(F)c(Cl)c1)c1cc(B(O)O)ccc1F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 1/20 0.58
NPC1 O15118 4/20 0.56
RAB9A P51151 4/20 0.56
SLC2A1 P11166 1/20 0.52
NPSR1 Q6W5P4 2/20 0.51
TSHR P16473 1/20 0.50
KMT2A Q03164 6/20 0.49
MAPT P10636 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 4/20 0.49
HTT P42858 3/20 0.49
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.48
HDAC3 O15379 1/20 0.47
EGFR P00533 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 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
SCHEMBL2560806 0.86 TP53 (0.50) FADS1NPC1RAB9AKMT2AMAPT
SCHEMBL29952640 0.81 MEN1 (0.55) NPC1RAB9AKMT2ASMN1; SMN2KDM4E
SCHEMBL4243110 0.81 MEN1 (0.55) NPC1RAB9AKMT2ASMN1; SMN2KDM4E
SCHEMBL29951533 0.81 NPC1 (0.68) FADS1NPC1RAB9ASLC2A1NPSR1
SCHEMBL15331049 0.80 HPGD (0.55) NPC1RAB9ATSHRKMT2AMAPT
SCHEMBL30566676 0.79 MAPK1 (0.54) RAB9AKMT2AMEN1HTTLMNA
SCHEMBL20766870 0.79 MAPK1 (0.54) RAB9AKMT2AMEN1HTTLMNA
SCHEMBL17465703 0.76 KMT2A (0.59) FADS1NPC1RAB9ATSHRKMT2A
SCHEMBL31333 0.75 TTR (0.55) SLC2A1NPSR1TSHRKMT2AMAPT
SCHEMBL18341118 0.74 P2RX1 (0.74) FADS1SLC2A1KMT2AMEN1HDAC3

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