SCHEMBL6985482

SCHEMBL6985482

CCOC(=O)C1CCCc2c1c1cc(OC)c(CCC(N)=O)cc1n2Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.45
PLA2G2A P14555 8/20 0.43
TSPO P30536 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
SCHEMBL6982276 0.92 HTR6 (0.43) HTR6TSPO
SCHEMBL6983411 0.92 HTR6 (0.45) HTR6TSPO
SCHEMBL6976610 0.91 HTR6 (0.48) HTR6PLA2G2ATSPO
SCHEMBL6697892 0.89 HTR6 (0.43) HTR6TSPO
SCHEMBL6697710 0.85 HTR6 (0.47) HTR6PLA2G2ATSPO
SCHEMBL6983468 0.84 HTR6 (0.51) HTR6PLA2G2ATSPO
SCHEMBL6694888 0.84 HTR6 (0.51) HTR6PLA2G2ATSPO
SCHEMBL4263164 0.81 HTR6 (0.55) HTR6TSPO
SCHEMBL6976613 0.80 HTR6 (0.46) HTR6PLA2G2ATSPO
SCHEMBL6983058 0.80 HTR6 (0.46) HTR6PLA2G2ATSPO

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
EP-0839806-B1 Substituted tricyclics LILLY CO ELI (US) 2003-07-09 EP disclosed
WO-1998018464-A1 SUBSTITUTED TRICYCLICS ELI LILLY AND COMPANY (US) 1998-05-07 WO disclosed
EP-0839806-A1 Substituted tricyclics ELI LILLY AND COMPANY (US) 1998-05-06 EP disclosed