SCHEMBL2559290

SCHEMBL2559290

NC(=O)C1CCCN1c1ccc(F)cc1C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.50
SCN9A Q15858 3/20 0.43
FPR2 P25090 1/20 0.43
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
DPP4 P27487 1/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ELANE P08246 2/20 0.38
GRM2 Q14416 1/20 0.37
HTR1A P08908 1/20 0.36
HTR7 P34969 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
RORC P51449 2/20 0.36
NR3C2 P08235 1/20 0.35
LCK P06239 2/20 0.35
AURKB Q96GD4 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
SCHEMBL2561494 0.96 AR (0.46) ARSCN9AFPR2MAOAMAOB
SCHEMBL15330912 0.82 AR (0.56) ARSCN9ADPP4ELANEHTR1A
SCHEMBL2563842 0.82 ALDH1A1 (0.53) ARALDH1A1HPGDGAA
SCHEMBL2556134 0.81 ALDH1A1 (0.52) ARSCN9AFPR2ALDH1A1HPGD
SCHEMBL2555259 0.78 AR (0.52) ARSCN9AELANEHTR1AHTR7
SCHEMBL2556044 0.78 AR (0.46) ARSCN9AFPR2ALDH1A1KDM4E
SCHEMBL2552969 0.78 PBK (0.46) SCN9AFPR2DPP4ALDH1A1KDM4E
SCHEMBL2559256 0.77 ALDH1A1 (0.55) ARSCN9AFPR2ALDH1A1KDM4E
SCHEMBL2560980 0.77 ALDH1A1 (0.49) SCN9AALDH1A1KDM4EGAA
SCHEMBL3047808 0.76 SCN9A (0.49) ARSCN9AFPR2DPP4ALDH1A1

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