SCHEMBL2552969

SCHEMBL2552969

NC(=O)C1CCCN(c2ccc(F)cc2C=O)C1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PBK Q96KB5 1/20 0.46
FPR2 P25090 1/20 0.46
SCN9A Q15858 1/20 0.46
KDM4E B2RXH2 3/20 0.45
HTT P42858 1/20 0.45
DPP4 P27487 3/20 0.44
DPP9 Q86TI2 3/20 0.44
DPP7 Q9UHL4 3/20 0.44
DPP8 Q6V1X1 2/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
HSD17B10 Q99714 4/20 0.43
GAA P10253 3/20 0.43
CDK9 P50750 1/20 0.42
HSD11B1 P28845 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.40
GLA P06280 1/20 0.40

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
Hydrochloric Acid SCHEMBL5425479 0.85 KDM4E (0.64) PBKFPR2SCN9AKDM4EHTT
SCHEMBL2560980 0.84 ALDH1A1 (0.49) SCN9AKDM4EGAAHSD11B1ALDH1A1
SCHEMBL2558933 0.83 PBK (0.49) PBKKDM4EPDE3BPDE3AHSD17B10
SCHEMBL2558977 0.82 ALDH1A1 (0.60) PBKFPR2SCN9AKDM4EHTT
SCHEMBL5442497 0.81 POLB (0.55) HTTGAAALDH1A1MAPK1
SCHEMBL28464943 0.79 ALDH1A1 (0.56) KDM4EHTTGAAALDH1A1HPGD
SCHEMBL2449550 0.78 NOTUM (0.61) PBKFPR2SCN9AKDM4EHSD17B10
SCHEMBL9984155 0.78 GAA (0.52) PBKFPR2SCN9AKDM4EHTT
SCHEMBL2559290 0.78 AR (0.50) FPR2SCN9AKDM4EHTTDPP4
SCHEMBL2555292 0.78 ALDH1A1 (0.39) HTTHSD11B1ALDH1A1MAPK1

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