SCHEMBL2551753

SCHEMBL2551753

CC(CCC(=O)O)Oc1cccc(C=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.46
MAOB P27338 5/20 0.46
SRC P12931 1/20 0.44
EPOR P19235 2/20 0.44
FFAR1 O14842 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
UNG P13051 1/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39

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
SCHEMBL2556328 0.84 ALDH1A3 (0.54) FFAR1NPC1RAB9AALDH1A1KDM4E
SCHEMBL11502513 0.81 MTNR1A (0.56) FFAR1NPC1RAB9AALDH1A1KDM4E
SCHEMBL8388111 0.81 SRC (0.52) MAOAMAOBSRCNPC1RAB9A
SCHEMBL17828395 0.80 MAOA (0.48) MAOAMAOBSRCNPC1RAB9A
SCHEMBL17828390 0.80 MAOA (0.48) MAOAMAOBSRCNPC1RAB9A
SCHEMBL17828384 0.80 MAOA (0.48) MAOAMAOBSRCNPC1RAB9A
SCHEMBL6593538 0.79 CYP3A4 (0.44) MAOBFFAR1ALDH1A1FFAR4MTNR1A
SCHEMBL8388447 0.79 SRC (0.54) MAOAMAOBSRCNPC1RAB9A
SCHEMBL2554999 0.78 MAOB (0.51) MAOAMAOBNPC1RAB9AALDH1A1
SCHEMBL4298184 0.77 GAA (0.51) MAOAMAOBSRCEPORNPC1

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