SCHEMBL2563136

SCHEMBL2563136

O=Cc1c(-c2ccccc2[N+](=O)[O-])nn(-c2ccccc2F)c1Br

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 5/20 0.39
MAPT P10636 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
LMNA P02545 1/20 0.38
KCNN4 O15554 3/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
PMM2 O15305 1/20 0.33
MPI P34949 1/20 0.33
PHOSPHO1 Q8TCT1 1/20 0.33
MAOB P27338 1/20 0.33
GFER P55789 1/20 0.32
ATM Q13315 1/20 0.32
GAA P10253 1/20 0.32
CFTR P13569 1/20 0.32
NPC1 O15118 1/20 0.32
ABCB1 P08183 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL2553414 0.91 CA2 (0.40) SMN1; SMN2ALDH1A1MAPTL3MBTL1LMNA
SCHEMBL2555008 0.86 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPTL3MBTL1LMNA
SCHEMBL29951228 0.85 KCNN4 (0.42) KCNN4KMT2A
SCHEMBL15330691 0.84 ALDH1A1 (0.41) ALDH1A1MAPTLMNATDP1KMT2A
SCHEMBL15330446 0.83 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1MAPTLMNACA1
SCHEMBL2559754 0.82 KCNN4 (0.40) KCNN4KMT2A
SCHEMBL15329338 0.82 MAPT (0.42) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL15329947 0.81 KCNN4 (0.44) ALDH1A1MAPTKCNN4GAAKMT2A
SCHEMBL2554684 0.80 CA1 (0.44) SMN1; SMN2ALDH1A1MAPTLMNACA1
SCHEMBL15330613 0.79 NPC1 (0.42) SMN1; SMN2ALDH1A1MAPTLMNAGAA

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