SCHEMBL2559320

SCHEMBL2559320

O=Cc1ccc(OC2(C(=O)O)CCOCC2)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 2/20 0.45
ALDH3A1 P30838 1/20 0.45
KMT2A Q03164 2/20 0.40
TTR P02766 1/20 0.40
ALDH1A1 P00352 7/20 0.39
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HPGD P15428 4/20 0.34
AOX1 Q06278 1/20 0.34
TSHR P16473 1/20 0.33
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32

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
SCHEMBL2563226 0.89 TTR (0.42) ALDH1A3ALDH3A1TTRALDH1A1HPGD
SCHEMBL2562038 0.88 TTR (0.41) ALDH1A3ALDH3A1TTRALDH1A1HPGD
SCHEMBL2558581 0.86 TTR (0.39) ALDH1A3ALDH3A1TTRALDH1A1HPGD
SCHEMBL2557449 0.80 TTR (0.37) ALDH1A3TTRALDH1A1HPGDAOX1
SCHEMBL2558816 0.77 ALDH1A1 (0.46) ALDH1A3KMT2AALDH1A1CYP4F2CYP4A11
SCHEMBL2557460 0.76 SRC (0.43) KMT2AALDH1A1MAPTNPC1RAB9A
SCHEMBL28375415 0.70 ALDH1A3 (0.49) ALDH1A3ALDH3A1TTRALDH1A1HPGD
SCHEMBL31117784 0.68 MAP4K4 (0.49) KMT2AALDH1A1LMNAHTTRAB9A
SCHEMBL18209464 0.67 TDP1 (0.66) TTRALDH1A1MAPTTDP1TSHR
SCHEMBL20570936 0.67 TDP1 (0.42) KMT2AALDH1A1LMNAMAPTHTT

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