SCHEMBL2559705

SCHEMBL2559705

Cc1oc(COc2cccc(C=O)c2)cc1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.62
RAB9A P51151 3/20 0.62
TDP1 Q9NUW8 2/20 0.62
APEX1 P27695 2/20 0.62
POLB P06746 2/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
MAOA P21397 7/20 0.54
MAOB P27338 7/20 0.54
TTR P02766 1/20 0.45
CCNB2 O95067 2/20 0.44
CDK1 P06493 2/20 0.44
CDK4 P11802 2/20 0.44
CCNB1 P14635 2/20 0.44
CCND1 P24385 2/20 0.44
CCNB3 Q8WWL7 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
PTGER4 P35408 1/20 0.43

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
SCHEMBL2562720 0.86 RAB9A (0.74) NPC1RAB9ATDP1APEX1POLB
SCHEMBL2560564 0.83 MAOA (0.52) NPC1RAB9ATDP1APEX1POLB
SCHEMBL29956346 0.79 NPC1 (0.62) NPC1RAB9ATDP1POLBL3MBTL1
SCHEMBL2557646 0.78 PTGER4 (0.70) NPC1RAB9ATDP1POLBMAOA
SCHEMBL2557002 0.76 NPC1 (0.63) NPC1RAB9ATDP1MAOAMAOB
SCHEMBL2554402 0.75 TP53 (0.56) NPC1RAB9ATDP1POLBL3MBTL1
SCHEMBL2555866 0.75 MAOA (0.55) NPC1RAB9ATDP1L3MBTL1MAOA
SCHEMBL2560715 0.75 MAOA (0.55) NPC1RAB9ATDP1POLBL3MBTL1
SCHEMBL29956891 0.74 MAOA (0.52) NPC1RAB9ATDP1POLBMAOA
SCHEMBL16398844 0.72 RAB9A (0.58) NPC1RAB9ATDP1MAOAMAOB

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