SCHEMBL2555397

SCHEMBL2555397

CC(=O)c1ccc(-c2cc(C(=O)O)ccc2F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KIF11 P52732 1/20 0.47
HSD17B1 P14061 2/20 0.46
RARB P10826 1/20 0.46
PTGS1 P23219 1/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
KDM4E B2RXH2 1/20 0.45
HSD17B10 Q99714 1/20 0.45
BCL2L1 Q07817 1/20 0.44
BAD Q92934 1/20 0.44
TTR P02766 1/20 0.43
PTGER1 P34995 1/20 0.43
MAPK14 Q16539 1/20 0.42
ERN1 O75460 1/20 0.42
PRKAB2 O43741 1/20 0.42
PRKAG1 P54619 1/20 0.42

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
SCHEMBL2559215 0.86 RARB (0.59) MAPTSMN1; SMN2KIF11HSD17B1RARB
SCHEMBL3215926 0.84 KMO (0.52) MAPTLMNAKDM4EHSD17B10BCL2L1
SCHEMBL16554362 0.84 TSHR (0.55) MAPTLMNAKDM4EHSD17B10BCL2L1
SCHEMBL1226198 0.84 PTGS1 (0.54) MAPTSMN1; SMN2KIF11HSD17B1PTGS1
SCHEMBL11314219 0.84 PTGS1 (0.54) MAPTSMN1; SMN2KIF11HSD17B1PTGS1
SCHEMBL2557497 0.84 AKR1C3 (0.52) MAPTSMN1; SMN2LMNAERN1MAOA
SCHEMBL16554472 0.84 PTGER1 (0.52) SMN1; SMN2RAB9AKDM4ETTRPTGER1
SCHEMBL22926305 0.83 FASN (0.51) MAPTSMN1; SMN2KIF11HSD17B1PTGS1
SCHEMBL17895484 0.83 CYP2A6 (0.47) MAPTSMN1; SMN2KIF11HSD17B1PTGS1
SCHEMBL29484269 0.83 CYP2A6 (0.47) MAPTSMN1; SMN2KIF11HSD17B1PTGS1

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