SCHEMBL2553382

SCHEMBL2553382

O=Cc1c(-c2cc(F)cc(F)c2)nn(-c2ccc(F)cc2F)c1Br

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
OPRM1 P35372 1/20 0.34
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
CNR1 P21554 3/20 0.31
CNR2 P34972 3/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
P2RX7 Q99572 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL15329779 0.91 LMNA (0.42) NPC1RAB9ALMNAL3MBTL1OPRM1
SCHEMBL15330979 0.90 NPC1 (0.41) NPC1RAB9ALMNAL3MBTL1OPRM1
SCHEMBL15332149 0.90 ESR1 (0.37)
SCHEMBL15331035 0.89 NPC1 (0.50) NPC1RAB9ALMNAL3MBTL1OPRM1
SCHEMBL15330512 0.88 LMNA (0.38) NPC1RAB9ALMNAL3MBTL1OPRM1
SCHEMBL2553185 0.87 KCNN4 (0.35) MAPK11MAPK14SCN5ASCN9A
SCHEMBL15330925 0.86 LMNA (0.41) NPC1RAB9ALMNATP53MAPT
SCHEMBL15331412 0.86 L3MBTL1 (0.36) NPC1RAB9ALMNAL3MBTL1OPRM1
SCHEMBL2562866 0.85 L3MBTL1 (0.35) NPC1RAB9ALMNAL3MBTL1OPRM1
SCHEMBL2562232 0.84 NPC1 (0.36) NPC1RAB9ALMNAL3MBTL1OPRM1

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