SCHEMBL2557735

SCHEMBL2557735

CC(=O)c1cccc(OCCCC(=O)O)c1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.61
RAB9A P51151 1/20 0.57
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.55
MAOA P21397 3/20 0.54
LMNA P02545 1/20 0.53
HTT P42858 1/20 0.53
ALDH1A1 P00352 1/20 0.53

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
SCHEMBL2554052 0.95 MAOB (0.60) MAOBRAB9AKMT2AMEN1MAOA
SCHEMBL3161479 0.94 MAOB (0.58) MAOBRAB9AKMT2AMEN1MAOA
SCHEMBL2554773 0.92 MAOB (0.63) MAOBRAB9AKMT2AMEN1MAOA
SCHEMBL11737749 0.87 MAOB (0.69) MAOBRAB9AKMT2AMEN1MAOA
SCHEMBL5974513 0.87 MAOB (0.68) MAOBRAB9AKMT2AMEN1MAOA
SCHEMBL25363724 0.85 ALDH1A1 (0.64) RAB9AKMT2AALDH1A1
SCHEMBL30530815 0.85 ALDH1A1 (0.64) RAB9AKMT2AALDH1A1
SCHEMBL15568678 0.84 MAOB (0.60) MAOBRAB9AKMT2AMEN1MAOA
SCHEMBL1436145 0.84 THRB (0.65) MAOBRAB9AKMT2AMEN1MAOA
SCHEMBL1545031 0.84 MAOB (0.60) MAOBRAB9AKMT2AMEN1MAOA

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