SCHEMBL2559211

SCHEMBL2559211

O=CC1CCCN(CC(=O)Nc2ccc(F)cc2)C1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.65
KDM4E B2RXH2 1/20 0.65
THRB P10828 1/20 0.65
SMN1; SMN2 Q16637 3/20 0.55
LMNA P02545 3/20 0.55
HTT P42858 2/20 0.55
ATM Q13315 1/20 0.54
GAA P10253 1/20 0.51
CHRNB2 P17787 1/20 0.49
CHRNB4 P30926 1/20 0.49
CHRNA3 P32297 1/20 0.49
CHRNA4 P43681 1/20 0.49
IDO1 P14902 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 1/20 0.48
DRD4 P21917 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
SCHEMBL15330243 0.89 MEN1 (0.52) ALDH1A1KDM4ETHRBSMN1; SMN2MEN1
SCHEMBL2562333 0.88 MAPT (0.53) ALDH1A1KDM4ETHRBSMN1; SMN2LMNA
SCHEMBL15330891 0.88 ALDH1A1 (0.63) ALDH1A1KDM4ESMN1; SMN2LMNAHTT
SCHEMBL2559118 0.86 KCNT1 (0.53) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1
SCHEMBL15331301 0.85 ALDH1A1 (0.68) ALDH1A1KDM4ETHRBSMN1; SMN2LMNA
SCHEMBL2559568 0.81 ALDH1A1 (0.65) ALDH1A1KDM4ESMN1; SMN2GAACHRNB2
SCHEMBL2560163 0.79 ALDH1A1 (0.64) ALDH1A1KDM4ELMNADRD4
SCHEMBL2556253 0.79 EPHX2 (0.54) ALDH1A1KDM4ELMNAHTTIDO1
SCHEMBL8230021 0.77 ALDH1A1 (0.63) ALDH1A1KDM4ETHRBSMN1; SMN2LMNA
SCHEMBL2558467 0.77 HTT (0.41) ALDH1A1KDM4ELMNAHTTMEN1

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