SCHEMBL2552759

SCHEMBL2552759

O=Cc1cc(-c2ccc(C(=O)O)cc2)cs1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 5/20 0.51
TRIM24 O15164 1/20 0.51
TRIM33 Q9UPN9 1/20 0.51
ALDH1A1 P00352 2/20 0.47
RXRA P19793 3/20 0.46
RXRB P28702 3/20 0.46
BCL2L1 Q07817 1/20 0.46
BAD Q92934 1/20 0.46
ALAD P13716 2/20 0.45
KDM4E B2RXH2 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
EGFR P00533 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 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
SCHEMBL2556885 0.81 KMO (0.56) ERN1TRIM24TRIM33ALDH1A1RXRA
SCHEMBL2558415 0.80 POLB (0.46) ERN1TRIM24TRIM33ALDH1A1KDM4E
SCHEMBL1471364 0.79 DAO (0.52) ERN1TRIM24TRIM33ALDH1A1RXRA
SCHEMBL379478 0.79 HDAC6 (0.44) TRIM24TRIM33ALDH1A1ALADKDM4E
SCHEMBL15332306 0.78 CA12 (0.47) ERN1ALDH1A1KDM4ETDP1EGFR
SCHEMBL30104097 0.78 PGR (0.44)
SCHEMBL29951347 0.78 ALAD (0.56) ALAD
SCHEMBL2560151 0.78 ADH5 (0.46) ERN1ALDH1A1KDM4ERAB9A
SCHEMBL2559757 0.78 ERN1 (0.43) ERN1TRIM24TRIM33ALDH1A1BCL2L1
SCHEMBL2559991 0.78 LDHA (0.55) ALDH1A1KDM4ETP53NPC1RAB9A

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