SCHEMBL2556885

SCHEMBL2556885

O=Cc1cc(-c2cccc(C(=O)O)c2)cs1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.56
ERN1 O75460 5/20 0.55
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
UNG P13051 1/20 0.50
TRIM24 O15164 1/20 0.47
TRIM33 Q9UPN9 1/20 0.47
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
KEAP1 Q14145 1/20 0.44
DDT P30046 1/20 0.42

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
SCHEMBL2552759 0.81 ERN1 (0.51) ERN1RXRARXRBKDM4EALDH1A1
SCHEMBL379478 0.79 HDAC6 (0.44) KDM4EALDH1A1TRIM24TRIM33LMNA
SCHEMBL30725957 0.78 KMO (0.86) KMOERN1RXRARXRBLMNA
SCHEMBL29904709 0.78 KMO (0.86) KMOERN1RXRARXRBLMNA
SCHEMBL71238 0.78 KMO (0.86) KMOERN1RXRARXRBLMNA
SCHEMBL26682030 0.78 HSD17B1 (0.61)
SCHEMBL15332306 0.77 CA12 (0.47) ERN1KDM4EALDH1A1POLBTDP1
SCHEMBL2557769 0.77 KDM5C (0.54) KMOKDM4EALDH1A1
Hydrochloric Acid SCHEMBL4350309 0.76 KMO (0.83) KMOERN1RXRARXRBLMNA
Hydrochloric Acid SCHEMBL21173951 0.76 KMO (0.83) KMOERN1RXRARXRBLMNA

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 8 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-2011135303-A2 UBIQUITINATION MODULATORS ITI SCOTLAND LIMITED (GB) 2011-11-03 WO disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed