SCHEMBL2559568

SCHEMBL2559568

O=CC1CCCN(CC(=O)Nc2ccccc2F)C1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.65
KDM4E B2RXH2 1/20 0.65
TSHR P16473 2/20 0.54
HSD17B10 Q99714 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
CHRNB2 P17787 3/20 0.53
CHRNB4 P30926 3/20 0.53
CHRNA3 P32297 3/20 0.53
CHRNA4 P43681 3/20 0.53
MAPT P10636 1/20 0.51
GFER P55789 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
DRD4 P21917 1/20 0.51
POLB P06746 3/20 0.49
CYP3A4 P08684 1/20 0.49
GAA P10253 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPK1 P28482 1/20 0.48

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
SCHEMBL2554175 0.86 HPGD (0.67) ALDH1A1TSHRHSD17B10L3MBTL1MAPT
SCHEMBL2560196 0.86 MEN1 (0.57) ALDH1A1KDM4EL3MBTL1MAPTSMN1; SMN2
SCHEMBL2561097 0.85 ALDH1A1 (0.63) ALDH1A1KDM4ETSHRHSD17B10L3MBTL1
SCHEMBL15330891 0.83 ALDH1A1 (0.63) ALDH1A1KDM4EMAPTSMN1; SMN2POLB
SCHEMBL2559211 0.81 ALDH1A1 (0.65) ALDH1A1KDM4ECHRNB2CHRNB4CHRNA3
SCHEMBL2559118 0.80 KCNT1 (0.53) ALDH1A1KDM4ETSHRMAPTSMN1; SMN2
SCHEMBL15330243 0.77 MEN1 (0.52) ALDH1A1KDM4ETSHRMAPTSMN1; SMN2
SCHEMBL2558467 0.77 HTT (0.41) ALDH1A1KDM4ETSHRL3MBTL1POLB
SCHEMBL29952957 0.76 HTT (0.58) ALDH1A1SMN1; SMN2GAAKMT2AHPGD
SCHEMBL2562333 0.76 MAPT (0.53) ALDH1A1KDM4EL3MBTL1MAPTSMN1; SMN2

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