SCHEMBL2558833

SCHEMBL2558833

CC(=O)c1ccc(-c2cccc(F)c2C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TTR P02766 1/20 0.49
FOLH1 Q04609 1/20 0.46
BRS3 P32247 4/20 0.44
NPSR1 Q6W5P4 1/20 0.43
PTGS1 P23219 1/20 0.43
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KIF11 P52732 1/20 0.42
HSD17B1 P14061 2/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
BDKRB1 P46663 1/20 0.40
LTB4R Q15722 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 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
SCHEMBL2560677 0.84 FOLH1 (0.48) MAPTSMN1; SMN2FOLH1NPSR1ALDH1A1
SCHEMBL7930737 0.83 MEN1 (0.50) TTRFOLH1BRS3CES2CES1
SCHEMBL1927711 0.83 FOLH1 (0.53) MAPTTTRFOLH1ALDH1A1L3MBTL1
SCHEMBL15332744 0.82 MAPT (0.52) MAPTSMN1; SMN2FOLH1ALDH1A1L3MBTL1
SCHEMBL6191307 0.81 MAPT (0.62) MAPTSMN1; SMN2NPSR1PTGS1ALDH1A1
SCHEMBL2559089 0.81 SMN1; SMN2 (0.50) MAPTSMN1; SMN2FOLH1ALDH1A1HSD17B1
SCHEMBL23354124 0.80 DHODH (0.47) MAPTSMN1; SMN2TTRFOLH1BRS3
SCHEMBL10304777 0.80 MAPT (0.48) MAPTSMN1; SMN2TTRNPSR1PTGS1
SCHEMBL29979189 0.80 DHODH (0.47) MAPTSMN1; SMN2TTRFOLH1BRS3
SCHEMBL29519049 0.80 CES2 (0.47) MAPTSMN1; SMN2FOLH1PTGS1ALDH1A1

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