SCHEMBL2558864

SCHEMBL2558864

O=Cc1ccc(OCC(=O)Nc2ccccc2Cl)cc1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.74
NPC1 O15118 6/20 0.74
POLB P06746 2/20 0.71
ALDH1A1 P00352 4/20 0.69
KDM4E B2RXH2 1/20 0.67
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
CTDSP1 Q9GZU7 1/20 0.61
HPGD P15428 4/20 0.58
MAPT P10636 4/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
TSHR P16473 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
HTT P42858 1/20 0.57
LMNA P02545 1/20 0.54

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
SCHEMBL2562427 0.86 RAB9A (0.69) RAB9ANPC1POLBALDH1A1KDM4E
SCHEMBL2556482 0.84 ALDH1A1 (0.69) RAB9ANPC1POLBALDH1A1KDM4E
SCHEMBL2554326 0.83 ALDH1A1 (0.70) RAB9ANPC1POLBALDH1A1KDM4E
SCHEMBL2561089 0.80 ALDH1A1 (0.67) RAB9ANPC1POLBALDH1A1KDM4E
SCHEMBL2556932 0.79 ALDH1A1 (0.62) RAB9ANPC1ALDH1A1KDM4EMEN1
SCHEMBL2557848 0.78 NPC1 (0.69) RAB9ANPC1POLBALDH1A1KDM4E
SCHEMBL2557846 0.78 MEN1 (0.70) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL2564545 0.76 MAPT (0.62) NPC1ALDH1A1MEN1KMT2AHPGD
SCHEMBL17967848 0.76 GAA (0.70) RAB9ANPC1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL4869349 0.76 CYP3A4 (0.68) RAB9ANPC1POLBALDH1A1KDM4E

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