SCHEMBL8374654

SCHEMBL8374654

O=Cc1cccc(OCCCCCCCCOc2cccc(C=O)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.62
MAOB P27338 7/20 0.62
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
SRC P12931 1/20 0.51
TLR4 O00206 1/20 0.49
TLR2 O60603 1/20 0.49
FURIN P09958 1/20 0.47
PRSS1 P07477 4/20 0.46
TSHR P16473 1/20 0.46
KCNA3 P22001 1/20 0.45

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
SCHEMBL8374655 1.00 MAOA (0.62) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL8716037 1.00 MAOA (0.62) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL30724528 0.98 MAOA (0.64) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL5543437 0.92 MAOA (0.66) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL7756955 0.92 TSHR (0.59) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL10497968 0.92 TSHR (0.59) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL6289516 0.92 TSHR (0.59) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL8863665 0.92 TSHR (0.59) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL3904389 0.92 TSHR (0.59) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL584475 0.92 TSHR (0.59) MAOAMAOBNPC1RAB9ATDP1

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-0802199-B1 Covalently bound dimers of glycopeptide antibiotics LILLY CO ELI (US) 1999-12-08 EP disclosed
EP-0801075-B1 Covalently linked dimers of glycopeptide antibiotics LILLY CO ELI (US) 1999-07-07 EP disclosed