SCHEMBL2551684

SCHEMBL2551684

CC(=O)c1cccc(OC2(C(=O)O)CCCCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 3/20 0.44
ABCB1 P08183 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GAA P10253 1/20 0.42
MAOA P21397 2/20 0.42
CTSK P43235 1/20 0.42

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
SCHEMBL2559861 0.98 MAOB (0.49) MAOBMEN1KMT2AALDH1A1ABCB1
SCHEMBL2561281 0.87 MAOB (0.47) MAOBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL2557458 0.83 MAPT (0.47) MAOBABCB1NPSR1NPC1RAB9A
SCHEMBL2561818 0.81 MAPT (0.48) MAOBKMT2AALDH1A1NPSR1NPC1
SCHEMBL18469680 0.81 CTSK (0.49) MEN1KMT2AALDH1A1NPSR1RAB9A
SCHEMBL2563498 0.81 MAOB (0.44) MAOBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL20599637 0.81 FAAH (0.48) ALDH1A1CYP1A2CYP3A4CTSK
SCHEMBL2558360 0.78 SRC (0.44) MAOBMEN1KMT2AALDH1A1NPC1
SCHEMBL2554828 0.78 SRC (0.44) MAOBMEN1KMT2AALDH1A1NPC1
SCHEMBL2557051 0.77 SRC (0.45) MAOBMEN1KMT2AALDH1A1NPC1

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