SCHEMBL2559522

SCHEMBL2559522

Cc1cccc(-c2[nH]c3c(F)c(Cl)ccc3c2C=O)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
ALOX5 P09917 1/20 0.35
PBRM1 Q86U86 2/20 0.34
FEN1 P39748 1/20 0.34
MAPT P10636 1/20 0.33
GPR17 Q13304 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
AKR1C2 P52895 1/20 0.32
AKR1C1 Q04828 1/20 0.32
KAT7 O95251 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL2551809 0.88 PTGES (0.36) PTGESCYP2D6CYP2C9ALOX5FEN1
SCHEMBL15331237 0.88 TNKS2 (0.39) GPR17TNKS2MEN1ALDH1A1KMT2A
SCHEMBL15331242 0.85 GPR17 (0.34) PTGESMAPTGPR17MEN1KMT2A
SCHEMBL15332353 0.85 TP53 (0.42) PTGESL3MBTL1ALOX5PBRM1MEN1
SCHEMBL15331128 0.83 L3MBTL1 (0.38) PTGESCYP2D6CYP2C9L3MBTL1ALOX5
SCHEMBL15333244 0.82 TP53 (0.41) PTGESCYP2D6CYP2C9ALOX5
SCHEMBL2555973 0.81 MAP2 (0.42) PTGESCYP2D6CYP2C9L3MBTL1ALOX5
SCHEMBL2563854 0.80 PTGES (0.37) PTGESL3MBTL1ALOX5MAPTALDH1A1
SCHEMBL2556025 0.79 GPR17 (0.36) GPR17TNKS2ALDH1A1
SCHEMBL15330118 0.79 KDM4E (0.44) PTGESALOX5MAPTALDH1A1KMT2A

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