SCHEMBL2562268

SCHEMBL2562268

CC(=O)c1cccc(-c2ccc(C(=O)O)cc2F)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 5/20 0.63
AKR1C2 P52895 5/20 0.63
KMO O15229 1/20 0.49
RARB P10826 1/20 0.48
AXL P30530 1/20 0.46
FOLH1 Q04609 1/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
NR1H4 Q96RI1 1/20 0.45
MAOA P21397 1/20 0.45
BLVRB P30043 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
AKR1B10 O60218 1/20 0.45
AKR1B1 P15121 1/20 0.45
AKR1C4 P17516 1/20 0.45
AKR1C1 Q04828 1/20 0.45
ERN1 O75460 1/20 0.45
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
ADH5 P11766 1/20 0.44

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
SCHEMBL2557497 0.88 AKR1C3 (0.52) AKR1C3AKR1C2KMOLMNAGAA
SCHEMBL10269902 0.85 PTGS1 (0.55) AKR1C3AKR1C2RARBLMNAAKR1C4
SCHEMBL2558335 0.84 CNR2 (0.56) AKR1C3AKR1C2KMOFOLH1LMNA
SCHEMBL2559215 0.84 RARB (0.59) AKR1C3AKR1C2RARBLMNAAKR1C4
SCHEMBL15329938 0.83 AKR1C3 (0.62) AKR1C3AKR1C2KMORARBFOLH1
SCHEMBL18397597 0.83 AKR1C3 (0.64) AKR1C3AKR1C2KMOFOLH1NR1H4
SCHEMBL120358 0.83 AKR1C3 (0.63) AKR1C3AKR1C2KMOAXLFOLH1
SCHEMBL505879 0.83 AKR1C3 (0.56) AKR1C3AKR1C2KMORARBAXL
SCHEMBL2041007 0.82 RARB (0.56) AKR1C3AKR1C2KMORARBAXL
SCHEMBL29473809 0.82 RARB (0.56) AKR1C3AKR1C2KMORARBAXL

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