SCHEMBL6693682

SCHEMBL6693682

COc1cc(OCCN)c2c3c(n(Cc4ccccc4)c2c1)CCCC3C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.49
TSPO P30536 2/20 0.41
PLA2G2A P14555 3/20 0.39
FABP4 P15090 2/20 0.37
PLA2G10 O15496 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
SCHEMBL29863082 0.91 HTR6 (0.51) HTR6TSPOPLA2G2AFABP4PLA2G10
SCHEMBL818490 0.91 HTR6 (0.51) HTR6TSPOPLA2G2AFABP4PLA2G10
SCHEMBL27862241 0.91 HTR6 (0.47) HTR6TSPOPLA2G2APLA2G10
SCHEMBL818425 0.91 HTR6 (0.47) HTR6PLA2G2AFABP4PLA2G10
SCHEMBL29862534 0.91 HTR6 (0.47) HTR6PLA2G2AFABP4PLA2G10
SCHEMBL6129641 0.90 HTR6 (0.47) HTR6PLA2G2AFABP4PLA2G10
SCHEMBL6129643 0.90 HTR6 (0.47) HTR6PLA2G2AFABP4PLA2G10
SCHEMBL6699097 0.88 HTR6 (0.45) HTR6TSPOPLA2G2APLA2G10
SCHEMBL819144 0.88 HTR6 (0.45) HTR6TSPOPLA2G2AFABP4PLA2G10
SCHEMBL29862390 0.88 HTR6 (0.42) HTR6TSPOPLA2G2AFABP4PLA2G10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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