SCHEMBL5504490

SCHEMBL5504490

O=C1CCCN1C1CCCC(Cc2c(Cl)cccc2-c2ccccc2)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
PDCD1LG2 Q9BQ51 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
HTR2C P28335 2/20 0.34
HCRTR1 O43613 2/20 0.34
HCRTR2 O43614 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2B P41595 1/20 0.34
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR2 P34972 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
MGLL Q99685 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
SCHEMBL5504613 0.84 HTR2C (0.39) POLBMEN1KMT2ADPP4DPP8
SCHEMBL5499906 0.84 LMNA (0.44) POLBMEN1KMT2ADPP4DPP8
SCHEMBL5504616 0.84 LMNA (0.44) POLBMEN1KMT2ADPP4DPP8
SCHEMBL5499746 0.84 DPP4 (0.36) POLBMEN1KMT2ADPP4DPP8
SCHEMBL5508747 0.84 CHRNB2 (0.40) HTR2CHCRTR1HCRTR2HTR2AHTR2B
SCHEMBL5503369 0.81 LMNA (0.43) POLBMEN1KMT2ADPP4DPP8
SCHEMBL5504207 0.79 MEN1 (0.33) POLBMEN1KMT2ADPP4DPP8
SCHEMBL5504232 0.79 CTSS (0.36) DPP4DPP8DPP9PDCD1LG2CD274
SCHEMBL5505692 0.79 HSD11B1 (0.40) HCRTR1HCRTR2ALDH1A1SMN1; SMN2MGLL
SCHEMBL5506971 0.79 CNR2 (0.32) PDCD1LG2CD274CNR2

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