SCHEMBL5504207

SCHEMBL5504207

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

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
F10 P00742 3/20 0.33
PDCD1LG2 Q9BQ51 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
P2RX7 Q99572 2/20 0.31
HRH3 Q9Y5N1 1/20 0.31
TACR1 P25103 1/20 0.31
BTK Q06187 1/20 0.31
HTR2C P28335 2/20 0.31
CTSS P25774 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2B P41595 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
SCHEMBL5499740 0.89 DPP4 (0.36) MEN1POLBKMT2ADPP4DPP8
SCHEMBL5503074 0.89 DPP4 (0.32) MEN1POLBKMT2ADPP4DPP8
SCHEMBL5506971 0.88 CNR2 (0.32) PDCD1LG2CD274CTSS
SCHEMBL5504186 0.85 F10 (0.35) DPP4DPP8DPP9F10P2RX7
SCHEMBL5502855 0.84 F10 (0.33) DPP4DPP8DPP9F10
SCHEMBL5500707 0.84 F10 (0.33) DPP4DPP8DPP9F10
SCHEMBL5503476 0.83 PDCD1LG2 (0.32) PDCD1LG2CD274
Hydrochloric Acid SCHEMBL5505492 0.82 PDCD1LG2 (0.31) PDCD1LG2CD274
SCHEMBL5503253 0.82 DPP4 (0.31) DPP4DPP8DPP9TACR1
SCHEMBL5504883 0.82 CYP11B2 (0.35) 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 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