SCHEMBL6697582

SCHEMBL6697582

COc1ccc(C)c2c1c1c(n2Cc2ccccc2)CCCC1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 6/20 0.44
FABP4 P15090 7/20 0.43
TSPO P30536 2/20 0.42
HTR6 P50406 1/20 0.41
FABP3 P05413 1/20 0.41

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
SCHEMBL818322 0.91 PLA2G2A (0.47) PLA2G2A
SCHEMBL27844976 0.91 FABP4 (0.39) PLA2G2AFABP4HTR6FABP3
SCHEMBL29862757 0.91 PLA2G2A (0.47) PLA2G2A
SCHEMBL6694139 0.90 TSPO (0.42) PLA2G2AFABP4TSPOHTR6FABP3
SCHEMBL6691723 0.90 TSPO (0.44) PLA2G2AFABP4TSPOHTR6FABP3
SCHEMBL6693186 0.89 PLA2G2A (0.49) PLA2G2A
SCHEMBL6129679 0.89 FABP4 (0.38) PLA2G2AFABP4HTR6FABP3
SCHEMBL6689210 0.89 TSPO (0.43) PLA2G2AFABP4TSPOFABP3
SCHEMBL8375901 0.87 FABP4 (0.43) PLA2G2AFABP4HTR6FABP3
SCHEMBL6689087 0.85 TSPO (0.41) PLA2G2AFABP4TSPOHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0952149-A2 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitiors ELI LILLY AND COMPANY (US) 1999-10-27 EP claimed
EP-0950657-B1 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitors LILLY CO ELI (US) 2004-07-14 EP disclosed
EP-0952149-B1 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitiors LILLY CO ELI (US) 2004-06-09 EP disclosed
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
EP-0950657-A2 Substituted carbazoles, process for their preparation and their use as sPLA2 inhibitors ELI LILLY AND COMPANY (US) 1999-10-20 EP disclosed