SCHEMBL5503929

SCHEMBL5503929

O=C1CCCN1C1CCC(O)C(Cc2ccc(-c3ccccc3)cc2Cl)C1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.36
NPY5R Q15761 3/20 0.35
BTK Q06187 1/20 0.35
P2RX7 Q99572 4/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
MMP13 P45452 1/20 0.33
ESR2 Q92731 1/20 0.33
OPRL1 P41146 2/20 0.33
PDCD1LG2 Q9BQ51 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
MGLL Q99685 1/20 0.31

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
SCHEMBL5499959 0.89 CYP11B1 (0.38) NPY5RP2RX7
SCHEMBL5500612 0.88 NPY5R (0.36) CTSSNPY5RP2RX7DPP4DPP8
SCHEMBL5500031 0.87 P2RX7 (0.44) P2RX7DPP4DPP8DPP9
SCHEMBL5502995 0.86 NPY5R (0.38) NPY5RP2RX7
SCHEMBL5500067 0.85 KMT2A (0.36) BTKP2RX7DPP4DPP8DPP9
SCHEMBL5504232 0.83 CTSS (0.36) CTSSNPY5RP2RX7DPP4DPP8
SCHEMBL5504727 0.79 NPY5R (0.37) NPY5R
SCHEMBL5504560 0.79 BTK (0.38) BTKP2RX7DPP4DPP8DPP9
SCHEMBL5501184 0.78 NPY5R (0.35) CTSSNPY5RBTKDPP4DPP8
SCHEMBL5509855 0.77 CYP11B2 (0.39) NPY5R

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