SCHEMBL2559124

SCHEMBL2559124

[C-]#[N+]C(CC(=O)OC)c1ccccc1F

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CTSA P10619 5/20 0.41
GAA P10253 2/20 0.40
MC4R P32245 1/20 0.40
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
HIF1A Q16665 1/20 0.39
EEF2K O00418 1/20 0.39
KCNA5 P22460 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL8770892 0.80 MEN1 (0.44) CNR2MEN1KMT2AGAAMC4R
SCHEMBL26455960 0.80 MEN1 (0.48) CNR2MEN1KMT2AGAAMC4R
SCHEMBL28032089 0.80 MEN1 (0.44) CNR2MEN1KMT2AGAAMC4R
SCHEMBL2555483 0.79 KCNA5 (0.49) MEN1KMT2AALDH1A1KCNA5
SCHEMBL21739932 0.77 KCNA5 (0.45) CNR2MEN1KMT2AMC4RALDH1A1
Hydrochloric Acid SCHEMBL381611 0.77 MEN1 (0.43) CNR2MEN1KMT2ACTSAGAA
Hydrochloric Acid SCHEMBL4599230 0.77 MEN1 (0.43) CNR2MEN1KMT2ACTSAGAA
SCHEMBL2555679 0.77 MEN1 (0.45) MEN1KMT2ACTSAALDH1A1LMNA
SCHEMBL2558509 0.75 ALDH1A1 (0.55) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL13186851 0.75 MC4R (0.41) CNR2MEN1KMT2ACTSAGAA

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