SCHEMBL5505968

SCHEMBL5505968

COC1CCC(N2CCCC2=O)CC1Cc1ccc(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 16/20 0.41
KMT2A Q03164 1/20 0.37
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
PDCD1LG2 Q9BQ51 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
F10 P00742 1/20 0.36

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
SCHEMBL5500075 0.90 PDCD1LG2 (0.35) P2RX7KMT2ADPP4DPP8DPP9
SCHEMBL5500031 0.85 P2RX7 (0.44) P2RX7KMT2ADPP4DPP8DPP9
SCHEMBL5505679 0.84 P2RX7 (0.44) P2RX7KMT2ADPP4DPP8DPP9
SCHEMBL5505217 0.83 P2RX7 (0.37) P2RX7KMT2A
SCHEMBL5499762 0.79 P2RX7 (0.42) P2RX7KMT2ADPP4DPP8DPP9
SCHEMBL5503988 0.76 P2RX7 (0.45) P2RX7DPP4DPP8DPP9F10
SCHEMBL5500515 0.76 P2RX7 (0.42) P2RX7KMT2A
SCHEMBL5506138 0.76 P2RX7 (0.46) P2RX7KMT2ADPP4DPP8DPP9
SCHEMBL4067724 0.75 HRH3 (0.39)
SCHEMBL5500067 0.75 KMT2A (0.36) P2RX7KMT2ADPP4DPP8DPP9

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