SCHEMBL2552756

SCHEMBL2552756

CC1CCCCC1(Oc1cccc(C=O)c1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.39
MAOA P21397 3/20 0.37
MAOB P27338 3/20 0.37
POLB P06746 2/20 0.37
ALDH1A1 P00352 1/20 0.37
UNG P13051 1/20 0.36
NPC1 O15118 4/20 0.35
RAB9A P51151 3/20 0.35
KMT2A Q03164 3/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
BLM P54132 1/20 0.34
MCL1 Q07820 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
CASP3 P42574 1/20 0.33

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
SCHEMBL2553965 0.85 ALDH1A1 (0.38) ALDH1A1RAB9AKMT2ATRPM8
SCHEMBL2557051 0.78 SRC (0.45) SRCMAOAMAOBPOLBALDH1A1
SCHEMBL2556961 0.78 SRC (0.40) SRCMAOAMAOBPOLBALDH1A1
SCHEMBL2558360 0.77 SRC (0.44) SRCMAOAMAOBPOLBALDH1A1
SCHEMBL2554828 0.77 SRC (0.44) SRCMAOAMAOBPOLBALDH1A1
SCHEMBL2556307 0.76 SRC (0.37) SRCMAOAMAOBPOLBALDH1A1
SCHEMBL16059965 0.72 ESR1 (0.35) GAAL3MBTL1
SCHEMBL16061613 0.72 ALDH1A1 (0.40) ALDH1A1KMT2AMAPTHPGDSMN1; SMN2
SCHEMBL2557460 0.70 SRC (0.43) SRCMAOAMAOBPOLBALDH1A1
SCHEMBL20710994 0.70 MAOA (0.43) SRCMAOAMAOBPOLBALDH1A1

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