SCHEMBL6776997

SCHEMBL6776997

Cc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3cccc(-c4ccccc4)c3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 14/20 0.48
PLA2G1B P04054 5/20 0.48
KLK1 P06870 3/20 0.44
KLKB1 P03952 1/20 0.44
PLA2G10 O15496 4/20 0.41
PLA2G5 P39877 3/20 0.41
PLA2G2E Q9NZK7 3/20 0.41
F10 P00742 1/20 0.41
ICMT O60725 1/20 0.38

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
SCHEMBL6690357 0.92 PLA2G2A (0.51) PLA2G2APLA2G1BPLA2G10PLA2G5PLA2G2E
SCHEMBL6770631 0.91 PLA2G2A (0.46) PLA2G2APLA2G1BKLK1KLKB1PLA2G10
SCHEMBL6774185 0.90 TP53 (0.47) PLA2G2APLA2G1BKLK1KLKB1F10
SCHEMBL6773103 0.90 PLA2G2A (0.44) PLA2G2APLA2G1BKLK1PLA2G10PLA2G5
SCHEMBL6691732 0.89 ADRA1D (0.44) PLA2G2AF10
SCHEMBL6777891 0.89 PLA2G2A (0.49) PLA2G2APLA2G1BKLK1KLKB1PLA2G10
SCHEMBL6773912 0.89 PLA2G2A (0.45) PLA2G2APLA2G1BKLK1KLKB1PLA2G10
SCHEMBL6889571 0.88 PLA2G2A (0.44) PLA2G2APLA2G1BKLK1KLKB1PLA2G10
SCHEMBL6776978 0.87 PLA2G2A (0.42) PLA2G2APLA2G1BKLK1PLA2G10PLA2G5
SCHEMBL6780031 0.87 PLA2G2A (0.44) PLA2G2APLA2G1BKLK1KLKB1PLA2G10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713645-B1 INHIBITING SPLA2 MEDIATED RELEASE OF FATTY ACIDS FOR TREATMENT OF CONDITIONS SUCH AS SEPTIC SHOCK ELI LILLY AND COMPANY 2004-03-30 US disclosed
US-6177440-B1 THERAPY FOR SEPSIS SHOCK; PHOSPHOLIPASE INHBITOR ELI LILLY AND COMPANY 2001-01-23 US disclosed
EP-0952149-A2 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitiors ELI LILLY AND COMPANY (US) 1999-10-27 EP disclosed