SCHEMBL9508740

SCHEMBL9508740

COc1ccc(C(OC[C@@H](O)[C@H](O)CO)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 9/20 0.49
TK1 P04183 1/20 0.45
KCNH2 Q12809 1/20 0.42
SLC6A1 P30531 2/20 0.41
SLC6A11 P48066 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CASR P41180 1/20 0.40

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
SCHEMBL3490250 0.88 KIF11 (0.49) KIF11TK1KCNH2SLC6A1SLC6A11
SCHEMBL15281845 0.88 KIF11 (0.49) KIF11TK1KCNH2SLC6A1SLC6A11
SCHEMBL16214813 0.87 KIF11 (0.50) KIF11KCNH2SLC6A1SLC6A11
SCHEMBL3487683 0.87 KIF11 (0.50) KIF11KCNH2SLC6A1SLC6A11
SCHEMBL17357645 0.85 KIF11 (0.44) KIF11TK1KCNH2SLC6A1SLC6A11
SCHEMBL24937040 0.85 LMNA (0.46) KIF11KCNH2SLC6A1SLC6A11MEN1
SCHEMBL10434091 0.85 LMNA (0.46) KIF11KCNH2SLC6A1SLC6A11MEN1
SCHEMBL10434128 0.85 LMNA (0.46) KIF11KCNH2SLC6A1SLC6A11MEN1
SCHEMBL1263156 0.84 KIF11 (0.61) KIF11KCNH2SLC6A1SLC6A11
SCHEMBL2897015 0.84 KIF11 (0.61) KIF11KCNH2SLC6A1SLC6A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0552185-A1 SYNTHESIS OF OLIGONUCLEOTIDES ZENECA LIMITED (GB) 1993-07-28 EP disclosed
WO-1992006103-A1 SYNTHESIS OF OLIGONUCLEOTIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-04-16 WO disclosed