SCHEMBL5503476

SCHEMBL5503476

O=C1CCCN1C1CCCC(Cc2c(Cl)ccc(-c3ccncc3)c2Cl)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDCD1LG2 Q9BQ51 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
LDHA P00338 1/20 0.31
LDHB P07195 1/20 0.31
CNR2 P34972 1/20 0.30

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
Hydrochloric Acid SCHEMBL5505492 0.99 PDCD1LG2 (0.31) PDCD1LG2CD274LDHALDHB
SCHEMBL5504883 0.89 CYP11B2 (0.35) PDCD1LG2CD274LDHACNR2
SCHEMBL5506971 0.88 CNR2 (0.32) PDCD1LG2CD274CNR2
Hydrochloric Acid SCHEMBL5503796 0.88 CYP11B2 (0.34) PDCD1LG2CD274LDHACNR2
SCHEMBL5501423 0.85 HTR6 (0.34)
Hydrochloric Acid SCHEMBL5506619 0.84 HTR6 (0.33)
SCHEMBL5504207 0.83 MEN1 (0.33) PDCD1LG2CD274
SCHEMBL5503412 0.82 PDCD1LG2 (0.33) PDCD1LG2CD274
Hydrochloric Acid SCHEMBL5504025 0.82 PDCD1LG2 (0.33) PDCD1LG2CD274
SCHEMBL5503074 0.81 DPP4 (0.32) PDCD1LG2CD274

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-1807072-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-07-18 EP claimed
WO-2006049952-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2006-05-11 WO claimed