SCHEMBL16370620

SCHEMBL16370620

COc1ccc(OCC(O)CN2CCOCC2)cc1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.74
KDM4E B2RXH2 2/20 0.74
POLB P06746 1/20 0.74
USP2 O75604 1/20 0.73
TSHR P16473 1/20 0.73
KMT2A Q03164 2/20 0.71
PKM P14618 1/20 0.71
MEN1 O00255 1/20 0.71
CYP2D6 P10635 1/20 0.71
SMN1; SMN2 Q16637 2/20 0.68
GAA P10253 2/20 0.68
MAPK1 P28482 2/20 0.67
ALDH1A1 P00352 1/20 0.67
ABCB1 P08183 2/20 0.65
MAPT P10636 1/20 0.65

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
SCHEMBL4578170 0.93 USP2 (0.83) L3MBTL1KDM4EUSP2TSHRKMT2A
SCHEMBL4578208 0.90 KDM4E (0.85) L3MBTL1KDM4EPOLBUSP2TSHR
SCHEMBL12834994 0.89 USP2 (0.81) L3MBTL1KDM4EUSP2TSHRKMT2A
SCHEMBL20444530 0.86 KMT2A (0.76) L3MBTL1KDM4EUSP2TSHRKMT2A
SCHEMBL16314566 0.86 USP2 (0.73) L3MBTL1KDM4EUSP2TSHRKMT2A
SCHEMBL10770632 0.86 USP2 (0.73) L3MBTL1KDM4EUSP2TSHRKMT2A
SCHEMBL20898158 0.86 TSHR (0.97) L3MBTL1KDM4EUSP2TSHRKMT2A
SCHEMBL31094196 0.86 L3MBTL1 (0.67) L3MBTL1KDM4EPOLBUSP2TSHR
SCHEMBL24378058 0.85 PKM (0.84) L3MBTL1KDM4EUSP2TSHRKMT2A
SCHEMBL8356145 0.85 PKM (0.84) L3MBTL1KDM4EUSP2TSHRKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015004485-A1 THERAPEUTIC COMPOUNDS ISIS INNOVATION LIMITED (GB) 2015-01-15 WO claimed
WO-2015004485-A1 THERAPEUTIC COMPOUNDS ISIS INNOVATION LIMITED (GB) 2015-01-15 WO disclosed
WO-2015004485-A1 THERAPEUTIC COMPOUNDS ISIS INNOVATION LIMITED (GB) 2015-01-15 WO disclosed