SCHEMBL2561494

SCHEMBL2561494

NC(=O)C1CCCCN1c1ccc(F)cc1C=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.46
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SCN9A Q15858 2/20 0.41
FPR2 P25090 1/20 0.41
GFER P55789 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
DPP4 P27487 1/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL2559290 0.96 AR (0.50) ARALDH1A1KDM4EHPGDHSD17B10
SCHEMBL2555259 0.83 AR (0.52) ARSCN9AGFERMEN1KMT2A
SCHEMBL2559256 0.81 ALDH1A1 (0.55) ARALDH1A1KDM4EHPGDHSD17B10
SCHEMBL15330912 0.79 AR (0.56) ARSCN9AMEN1KMT2ADPP4
SCHEMBL2563842 0.78 ALDH1A1 (0.53) ARALDH1A1HPGDGAAMEN1
SCHEMBL2556134 0.77 ALDH1A1 (0.52) ARALDH1A1HPGDSCN9AFPR2
SCHEMBL2556090 0.76 ALDH1A3 (0.57) ARALDH1A1KDM4EHPGDGFER
SCHEMBL2560980 0.76 ALDH1A1 (0.49) ALDH1A1KDM4ESCN9AGAAKMT2A
SCHEMBL28464943 0.76 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDGAAHTT
SCHEMBL2552969 0.74 PBK (0.46) ALDH1A1KDM4EHPGDHSD17B10SCN9A

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