SCHEMBL6659549

SCHEMBL6659549

CCOC(=O)[C@H](O)c1cc(OC)c(O)c(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.47
PKM P14618 3/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
ALDH1A1 P00352 2/20 0.44
GAA P10253 2/20 0.44
KDM4E B2RXH2 1/20 0.44
KMT2A Q03164 1/20 0.44
BLM P54132 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL6659548 1.00 LMNA (0.47) LMNAPOLBPKMCA12CA1
SCHEMBL31319539 0.85 LMNA (0.48) LMNAPOLBPKMCA12CA1
SCHEMBL490307 0.83 PKM (0.48) LMNAPOLBPKMCA12CA1
SCHEMBL9381287 0.82 CA12 (0.52) LMNAPOLBCA12CA1CA2
SCHEMBL29191471 0.80 TSHR (0.51) CA12CA1CA2CA9ALDH1A1
SCHEMBL11135068 0.79 BLM (0.67) LMNAPKMCA12CA1CA2
SCHEMBL669094 0.79 LMNA (0.55) LMNAPKMCA12CA1CA2
SCHEMBL11135072 0.79 BLM (0.67) LMNAPKMCA12CA1CA2
SCHEMBL491022 0.75 LDHA (0.47) LMNAPOLBPKMCA12CA1
SCHEMBL15241060 0.74 CYP3A4 (0.49) LMNAPKMCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004012506-A2 ANTIMICROBIAL COMPOUNDS EXEGENICS, INC. (US) 2004-02-12 WO disclosed