SCHEMBL27768455

SCHEMBL27768455

CCc1c(OC(C)=O)c2cc(O)ccc2n1Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 14/20 0.62
MAPT P10636 3/20 0.55
PKM P14618 3/20 0.55
GAA P10253 2/20 0.55
KDM4E B2RXH2 2/20 0.55
LMNA P02545 1/20 0.55
ALDH1A1 P00352 1/20 0.54
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ABCB11 O95342 1/20 0.47
ELANE P08246 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
SCHEMBL4664582 0.91 PLA2G2A (0.54) PLA2G2AMAPTPKMGAAKDM4E
SCHEMBL27789967 0.83 S1PR3 (0.53) PLA2G2AMAPTPKMGAAKDM4E
SCHEMBL290764 0.81 PLA2G2A (0.67) PLA2G2AMAPTPKMGAAKDM4E
SCHEMBL14880137 0.80 MAPT (0.74) PLA2G2AMAPTPKMGAAKDM4E
SCHEMBL2001954 0.79 PLA2G2A (0.83) PLA2G2AMAPTPKMGAAKDM4E
SCHEMBL27789965 0.79 FABP4 (0.43) PLA2G2AMAPTPKMGAAKDM4E
SCHEMBL4668204 0.78 PLA2G2A (0.50) PLA2G2A
SCHEMBL337321 0.77 PLA2G2A (0.60) PLA2G2AMAPTPKMGAAKDM4E
SCHEMBL7961676 0.77 PLA2G2A (1.00) PLA2G2A
SCHEMBL8235996 0.76 MEN1 (0.62) PLA2G2AMAPTPKMGAAKDM4E

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
CN-102850324-A Indole compounds MICROBIA INC 2013-01-02 CN disclosed
CN-101563337-A Indole compounds MICROBIA INC (US) 2009-10-21 CN disclosed