SCHEMBL6890366

SCHEMBL6890366

CCc1cc(O)c2c3c(C(=O)OC)cccc3n(Cc3ccccc3-c3ccccc3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 10/20 0.45
PLA2G1B P04054 2/20 0.42
PLA2G10 O15496 1/20 0.42
PLA2G5 P39877 1/20 0.42
EGFR P00533 1/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
USP2 O75604 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 2/20 0.37
RECQL P46063 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
PLEC Q15149 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
GAA P10253 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL6894747 0.91 PLA2G2A (0.44) PLA2G2APLA2G1BPLA2G10PLA2G5EGFR
SCHEMBL6893816 0.91 PLA2G2A (0.42) PLA2G2APLA2G1BPLA2G10PLA2G5LTB4R2
SCHEMBL6774091 0.90 PLA2G2A (0.47) PLA2G2APLA2G1BPLA2G10PLA2G5
SCHEMBL6894528 0.89 PLA2G2A (0.45) PLA2G2APLA2G1BPLA2G10PLA2G5EGFR
SCHEMBL6689220 0.89 PLA2G2A (0.47) PLA2G2APLA2G1BPLA2G10PLA2G5EGFR
SCHEMBL6894814 0.88 MAPT (0.44) PLA2G2AMEN1KMT2AALDH1A1KDM4E
SCHEMBL6897168 0.87 PLA2G1B (0.44) PLA2G2APLA2G1BMEN1KMT2AALDH1A1
SCHEMBL6897303 0.87 PLA2G2A (0.42) PLA2G2APLA2G1BEGFRALDH1A1MAPT
SCHEMBL6894723 0.87 MAPT (0.45) PLA2G2AMEN1KMT2AALDH1A1KDM4E
SCHEMBL6896741 0.87 PLA2G2A (0.41) PLA2G2APLA2G1BPLA2G10PLA2G5EGFR

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