SCHEMBL2556009

SCHEMBL2556009

COc1ccc(COCCC=CC=CC=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.45
AGXT P21549 2/20 0.45
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
APP P05067 7/20 0.39
CMA1 P23946 1/20 0.38
PPARG P37231 1/20 0.38
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL2556007 1.00 IDO1 (0.45) IDO1AGXTTDP1L3MBTL1NPC1
SCHEMBL16919290 0.94 IDO1 (0.47) IDO1AGXTTDP1L3MBTL1NPC1
SCHEMBL9715527 0.81 TDP1 (0.50) IDO1AGXTTDP1L3MBTL1NPC1
SCHEMBL8064124 0.77 IDO1 (0.49) IDO1AGXTTDP1L3MBTL1NPC1
SCHEMBL8064127 0.77 IDO1 (0.49) IDO1AGXTTDP1L3MBTL1NPC1
SCHEMBL13041109 0.76 L3MBTL1 (0.52) IDO1AGXTTDP1L3MBTL1NPC1
SCHEMBL8499580 0.75 IDO1 (0.61) IDO1AGXTTDP1L3MBTL1CA1
SCHEMBL18031455 0.74 ALDH1A1 (0.56) IDO1AGXTTDP1L3MBTL1CA1
SCHEMBL28420417 0.74 L3MBTL1 (0.57) IDO1AGXTTDP1L3MBTL1NPC1
SCHEMBL12552662 0.73 CNR1 (0.54) IDO1AGXTTDP1L3MBTL1

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