SCHEMBL6983124

SCHEMBL6983124

N#CCCc1cc2c(cc1OCCCC(=O)O)c1c(n2Cc2ccccc2)CCCC1NC=O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 13/20 0.40
HTR6 P50406 3/20 0.35
FABP4 P15090 1/20 0.33

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
SCHEMBL818662 0.92 PLA2G2A (0.42) PLA2G2AHTR6FABP4
SCHEMBL6970677 0.92 PLA2G2A (0.39) PLA2G2AHTR6
SCHEMBL29862814 0.86 PLA2G2A (0.45) PLA2G2AHTR6
SCHEMBL818540 0.86 PLA2G2A (0.45) PLA2G2AHTR6
SCHEMBL6978340 0.83 PLA2G2A (0.41) PLA2G2AHTR6
SCHEMBL8575155 0.81 HTR6 (0.33) HTR6FABP4
SCHEMBL6978338 0.79 HTR6 (0.36) HTR6FABP4
SCHEMBL6993129 0.78 HTR6 (0.38) HTR6FABP4
SCHEMBL3262705 0.77 PLA2G2A (0.45) PLA2G2AHTR6FABP4
SCHEMBL6993132 0.76 FABP4 (0.35) HTR6FABP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0839806-B1 Substituted tricyclics LILLY CO ELI (US) 2003-07-09 EP disclosed
EP-0839806-A1 Substituted tricyclics ELI LILLY AND COMPANY (US) 1998-05-06 EP disclosed