SCHEMBL2555552

SCHEMBL2555552

CC(Oc1ccc(Br)cc1C=O)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.51
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 2/20 0.46
ALDH1A1 P00352 1/20 0.46
ALOX12 P18054 1/20 0.46
HTT P42858 1/20 0.46
ERN1 O75460 4/20 0.44
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
ATM Q13315 1/20 0.40
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
AR P10275 1/20 0.38
HPGD P15428 2/20 0.38
HSD11B1 P28845 1/20 0.38
TNFRSF1A P19438 1/20 0.36
TSHR P16473 2/20 0.36

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
SCHEMBL31394698 0.87 PTGDR2 (0.56) PTGDR2LMNASMN1; SMN2MAPTPOLB
SCHEMBL28709175 0.87 PTGDR2 (0.56) PTGDR2LMNASMN1; SMN2MAPTPOLB
SCHEMBL2297920 0.87 PTGDR2 (0.56) PTGDR2LMNASMN1; SMN2MAPTPOLB
SCHEMBL29634295 0.84 PTGDR2 (0.50) PTGDR2LMNASMN1; SMN2MAPTPOLB
SCHEMBL22821647 0.84 PTGDR2 (0.50) PTGDR2LMNASMN1; SMN2MAPTPOLB
SCHEMBL15329716 0.84 SRC (0.42) ALDH1A1ERN1HDAC1HDAC2HDAC8
SCHEMBL15330657 0.83 PTGDR2 (0.49) PTGDR2LMNASMN1; SMN2MAPTPOLB
SCHEMBL2554190 0.82 TSHR (0.49) PTGDR2LMNASMN1; SMN2MAPTALDH1A1
SCHEMBL13903645 0.82 PTGDR2 (0.51) PTGDR2LMNASMN1; SMN2MAPTPOLB
SCHEMBL15332015 0.82 PTGDR2 (0.51) PTGDR2LMNASMN1; SMN2MAPTPOLB

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