SCHEMBL15330607

SCHEMBL15330607

CCOc1cccc(C=O)c1OC(C)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
GLA P06280 1/20 0.41
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
SRC P12931 1/20 0.39
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
TLR2 O60603 1/20 0.38
ERN1 O75460 1/20 0.38

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
SCHEMBL5562717 0.88 PTGDR2 (0.41) KMT2APTGDR2L3MBTL1GLAPTGS1
SCHEMBL2553823 0.88 KMT2A (0.42) KMT2APTGDR2L3MBTL1GLASRC
SCHEMBL15331030 0.86 KMT2A (0.40) KMT2APTGDR2L3MBTL1SRCKDM4E
SCHEMBL2561677 0.85 SMN1; SMN2 (0.43) KMT2APTGDR2L3MBTL1SRCKDM4E
SCHEMBL15331107 0.85 KMT2A (0.58) KMT2AACMSDSRCKDM4ENPC1
SCHEMBL7360392 0.85 SRC (0.41) KMT2APTGDR2L3MBTL1GLASRC
SCHEMBL20108986 0.83 ALDH1A1 (0.42) KMT2APTGDR2L3MBTL1PTGS1PTGS2
SCHEMBL18124583 0.81 ALDH1A1 (0.43) KMT2APTGDR2L3MBTL1SRCKDM4E
SCHEMBL181586 0.79 ALDH1A1 (0.50) KMT2APTGDR2L3MBTL1GLASRC
SCHEMBL29922833 0.79 ALDH1A1 (0.50) KMT2APTGDR2L3MBTL1GLASRC

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 5 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