SCHEMBL5506971

SCHEMBL5506971

O=C1CCCN1C1CCCC(Cc2c(Cl)ccc(-c3ccc(O)cc3)c2Cl)C1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.32
CTSS P25774 1/20 0.30
PARP1 P09874 1/20 0.30
PARP2 Q9UGN5 1/20 0.30
PDCD1LG2 Q9BQ51 1/20 0.30
CD274 Q9NZQ7 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
SCHEMBL5503476 0.88 PDCD1LG2 (0.32) CNR2PDCD1LG2CD274
SCHEMBL5504207 0.88 MEN1 (0.33) CTSSPDCD1LG2CD274
Hydrochloric Acid SCHEMBL5505492 0.87 PDCD1LG2 (0.31) PDCD1LG2CD274
SCHEMBL5504883 0.85 CYP11B2 (0.35) CNR2PDCD1LG2CD274
Hydrochloric Acid SCHEMBL5503796 0.84 CYP11B2 (0.34) CNR2PDCD1LG2CD274
SCHEMBL5503074 0.81 DPP4 (0.32) PDCD1LG2CD274
SCHEMBL5499740 0.81 DPP4 (0.36) PDCD1LG2CD274
SCHEMBL5499827 0.80 P2RX7 (0.34) CTSS
SCHEMBL5504186 0.80 F10 (0.35)
SCHEMBL5504490 0.79 POLB (0.35) CNR2PDCD1LG2CD274

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 disclosed
WO-2006049952-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2006-05-11 WO disclosed