SCHEMBL15330869

SCHEMBL15330869

CC(=O)c1cccc(-c2cnc(N)cc2C(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDT P30046 1/20 0.49
FYN P06241 4/20 0.46
ATR Q13535 2/20 0.46
EIF4E P06730 1/20 0.46
MAP4K4 O95819 3/20 0.45
CLK4 Q9HAZ1 3/20 0.45
CSNK1G2 P78368 2/20 0.45
MKNK2 Q9HBH9 2/20 0.45
MAP4K5 Q9Y4K4 2/20 0.45
DHFR P00374 2/20 0.44
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRA2 P47869 2/20 0.44
GABRB2 P47870 2/20 0.44

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
SCHEMBL2559953 0.85 DDT (0.50) DDTFYNATREIF4EMAP4K4
SCHEMBL2562012 0.85 GABRP (0.51) ATREIF4EMAP4K4MKNK2GABRP
SCHEMBL2552881 0.78 TRIM24 (0.48) DDTMAP4K4GABRPGABRDGABRA1
SCHEMBL2556869 0.78 DDT (0.51) DDTFYNEIF4EMAP4K4CLK4
SCHEMBL28494615 0.77 KMO (0.49) EIF4EMKNK2GABRPGABRDGABRA1
SCHEMBL15332468 0.77 IKBKE (0.58) FYNATRMAP4K4CLK4CSNK1G2
SCHEMBL6792767 0.75 UCHL5 (0.54) DDTEIF4EMAP4K4CLK4KDR
SCHEMBL29952530 0.75 UCHL5 (0.54) DDTEIF4EMAP4K4CLK4KDR
SCHEMBL1021238 0.75 DDT (0.51) DDTATRMAP4K4DHFRGABRP
SCHEMBL2560779 0.75 DDT (0.51) DDTFYNATREIF4EMAP4K4

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 5 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