SCHEMBL7968907

SCHEMBL7968907

NC(=O)c1cccc2c1c1c(C(=O)C(=O)O)cc(CO)cc1n2Cc1ccccc1Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.41
PLA2G2A P14555 15/20 0.39
PLA2G1B P04054 4/20 0.39
PLA2G10 O15496 2/20 0.39
PLA2G5 P39877 2/20 0.39
BRD4 O60885 2/20 0.35
PLA2G2E Q9NZK7 1/20 0.35
SYK P43405 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35

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
SCHEMBL7968908 0.86 CTNNB1 (0.39) CTNNB1PLA2G2APLA2G1BPLA2G10PLA2G5
SCHEMBL7968911 0.86 PLA2G2A (0.45) CTNNB1PLA2G2APLA2G1BPLA2G10PLA2G5
SCHEMBL27530208 0.83 CTNNB1 (0.40) CTNNB1PLA2G2APLA2G1BPLA2G10PLA2G5
SCHEMBL6773208 0.82 CTNNB1 (0.42) CTNNB1PLA2G2APLA2G1BPLA2G10PLA2G5
SCHEMBL6771899 0.81 CTNNB1 (0.43) CTNNB1PLA2G2APLA2G1BPLA2G10PLA2G5
SCHEMBL6774146 0.81 CTNNB1 (0.49) CTNNB1PLA2G2APLA2G1BPLA2G10PLA2G5
SCHEMBL6776025 0.80 CTNNB1 (0.43) CTNNB1PLA2G2APLA2G1BPLA2G10PLA2G5
SCHEMBL7963737 0.79 PLA2G2A (0.47) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL6772666 0.79 CTNNB1 (0.41) CTNNB1PLA2G2A
SCHEMBL7966738 0.79 PLA2G2A (0.52) CTNNB1PLA2G2APLA2G1BPLA2G10PLA2G5

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
US-6177440-B1 THERAPY FOR SEPSIS SHOCK; PHOSPHOLIPASE INHBITOR ELI LILLY AND COMPANY 2001-01-23 US disclosed