SCHEMBL2558151

SCHEMBL2558151

CC(=O)c1cccc(-c2ccc(C(=O)O)c(O)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 3/20 0.67
HNF4A P41235 2/20 0.67
XDH P47989 2/20 0.57
SLC22A12 Q96S37 1/20 0.57
ACLY P53396 1/20 0.52
PKM P14618 1/20 0.49
KMT2A Q03164 1/20 0.49
MCL1 Q07820 2/20 0.49
DHFR P00374 1/20 0.49
HDAC2 Q92769 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
ERN1 O75460 1/20 0.48
KMO O15229 1/20 0.47

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
SCHEMBL2562161 0.85 ACMSD (0.68) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL10024264 0.84 RXRB (0.53) ACLYHDAC2LMNAGAAKMO
SCHEMBL2556397 0.83 ACLY (0.51) ACLYDHFRHDAC2LMNAGAA
SCHEMBL2556733 0.83 EIF4E (0.53) XDHACLYHDAC2LMNAGAA
SCHEMBL3304188 0.82 MAOB (0.60) MCL1
SCHEMBL3839830 0.81 ALDH1A1 (0.57) ACMSDHNF4APKMKMT2AGAA
SCHEMBL29810721 0.81 ACMSD (1.00) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL2536183 0.81 ACMSD (1.00) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL29951818 0.81 KMO (0.70) HDAC2LMNAGAAERN1KMO
SCHEMBL3015814 0.81 KMO (0.70) HDAC2LMNAGAAERN1KMO

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