SCHEMBL2560045

SCHEMBL2560045

O=Cc1ccccc1-c1ccc(C(=O)O)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.54
PTGER3 P43115 1/20 0.54
PTGER2 P43116 1/20 0.54
EIF4E P06730 2/20 0.52
PDK2 Q15119 2/20 0.49
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.44
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43
ERN1 O75460 1/20 0.42
XDH P47989 1/20 0.42
ACMSD Q8TDX5 2/20 0.40
MCL1 Q07820 2/20 0.40
FTO Q9C0B1 2/20 0.39
HNF4A P41235 1/20 0.39

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
SCHEMBL15331304 0.88 EIF4E (0.55) PTGER1PTGER3PTGER2EIF4EALDH1A1
SCHEMBL28006913 0.86 ACMSD (0.46) PTGER1PTGER3PTGER2EIF4EALDH1A1
SCHEMBL2560042 0.83 ACMSD (0.60) TSHRALDH1A1ERN1XDHACMSD
SCHEMBL5924975 0.82 ALDH1A1 (0.57) PTGER1PTGER3PTGER2EIF4EPDK2
SCHEMBL2562357 0.82 ACMSD (0.50) PTGER1PTGER3PTGER2EIF4EALDH1A1
SCHEMBL6260642 0.80 PTGER1 (0.62) PTGER1PTGER3PTGER2EIF4EALDH1A1
SCHEMBL4919267 0.80 ERN1 (0.51) PTGER1PTGER3PTGER2EIF4EPDK2
SCHEMBL8926730 0.80 ESR2 (0.53) PTGER1PTGER3PTGER2EIF4EALDH1A1
SCHEMBL2559727 0.79 ACMSD (0.54) PTGER1PTGER3PTGER2EIF4EALDH1A1
SCHEMBL15332013 0.79 KMT2A (0.59) PTGER1PTGER3PTGER2EIF4EALDH1A1

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