SCHEMBL2559935

SCHEMBL2559935

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.43
MAOB P27338 7/20 0.43
UNG P13051 1/20 0.42
SRC P12931 1/20 0.41
NPC1 O15118 3/20 0.39
RAB9A P51151 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 2/20 0.39
POLB P06746 2/20 0.39
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
FBP1 P09467 1/20 0.37
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
EPOR P19235 1/20 0.37
PPARG P37231 2/20 0.36

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
SCHEMBL2553855 0.87 MAOA (0.41) MAOAMAOBUNGSRCNPC1
SCHEMBL2554985 0.85 PPARG (0.48) MAOAMAOBUNGSRCNPC1
SCHEMBL2555711 0.83 ALDH1A3 (0.44) ALDH1A1KMT2AMAPTPPARGPPARA
SCHEMBL15329910 0.83 SMN1; SMN2 (0.44) MAOAMAOBUNGSRCNPC1
SCHEMBL2556213 0.83 MAOA (0.43) MAOAMAOBUNGSRCNPC1
SCHEMBL15329664 0.81 SRC (0.43) MAOAMAOBUNGSRCNPC1
SCHEMBL2559244 0.80 MAOB (0.48) MAOAMAOBNPC1RAB9APOLB
SCHEMBL3066417 0.79 SRC (0.46) MAOAMAOBUNGSRCNPC1
SCHEMBL2174559 0.79 PPARA (0.51) MAOAMAOBUNGSRCALDH1A1
SCHEMBL2559614 0.77 ALDH1A1 (0.39) ALDH1A1POLBFBP1

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