SCHEMBL4130462

SCHEMBL4130462

O=C1CCCN1C1CCC(F)(F)C(Cc2ccc(Br)cc2Cl)C1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
KMT2A Q03164 2/20 0.37
P2RX7 Q99572 7/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
OPRL1 P41146 1/20 0.32
F10 P00742 1/20 0.32
NPY5R Q15761 1/20 0.32
OPRM1 P35372 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL5500736 0.80 KMT2A (0.35) DPP4DPP8DPP9KMT2AP2RX7
SCHEMBL3941646 0.78 DPP4 (0.37) DPP4DPP8DPP9OPRL1F10
SCHEMBL5500067 0.78 KMT2A (0.36) DPP4DPP8DPP9KMT2AP2RX7
SCHEMBL5499828 0.77 DPP4 (0.38) DPP4DPP8DPP9KMT2AP2RX7
SCHEMBL3946945 0.77 NPY5R (0.40) DPP4DPP8DPP9OPRL1F10
SCHEMBL5506138 0.76 P2RX7 (0.46) DPP4DPP8DPP9KMT2AP2RX7
SCHEMBL5500075 0.76 PDCD1LG2 (0.35) DPP4DPP8DPP9KMT2AP2RX7
SCHEMBL3945085 0.73 CYP11B2 (0.38) DPP4DPP8DPP9OPRL1NPY5R
SCHEMBL5499762 0.71 P2RX7 (0.42) DPP4DPP8DPP9KMT2AP2RX7
SCHEMBL5505772 0.71 KMT2A (0.35) KMT2AP2RX7L3MBTL1SMN1; SMN2

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-2049475-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 Eli Lilly & Company (US) 2009-04-22 EP disclosed
WO-2007127704-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 WO disclosed