SCHEMBL2482533

SCHEMBL2482533

Cn1nc(C(C)(C)C)c(Cl)c1-c1nc2cc(-c3ccccc3Cl)nc(OCC(F)(F)F)c2[nH]1.[NaH]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.59
PTGES O14684 2/20 0.33
KDM4E B2RXH2 2/20 0.32
SCN9A Q15858 2/20 0.32
P2RX7 Q99572 1/20 0.31
L3MBTL1 Q9Y468 3/20 0.31
GAA P10253 1/20 0.31
POLB P06746 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PDE10A Q9Y233 5/20 0.30
PDE2A O00408 4/20 0.30
NPC1 O15118 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL15753949 0.99 TRPM8 (0.60) TRPM8PTGESKDM4ESCN9AP2RX7
SCHEMBL2482537 0.98 TRPM8 (0.59) TRPM8PTGESKDM4ESCN9AP2RX7
SCHEMBL2486018 0.93 TRPM8 (0.50) TRPM8KDM4ESCN9APDE10APDE2A
SCHEMBL2448318 0.92 TRPM8 (0.51) TRPM8KDM4ESCN9APDE10APDE2A
SCHEMBL2486020 0.91 TRPM8 (0.50) TRPM8KDM4ESCN9APDE10APDE2A
SCHEMBL2485363 0.90 TRPM8 (0.48) TRPM8KDM4ESCN9APOLBNPSR1
SCHEMBL2483336 0.90 TRPM8 (0.63) TRPM8PTGESKDM4EL3MBTL1GAA
SCHEMBL2448441 0.90 TRPM8 (0.49) TRPM8KDM4ESCN9APOLBNPSR1
SCHEMBL2485365 0.89 TRPM8 (0.48) TRPM8KDM4ESCN9APOLBNPSR1
SCHEMBL2452068 0.88 TRPM8 (0.73) TRPM8PTGESKDM4EL3MBTL1PDE10A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2542552-B1 SUBSTITUTED AZA-BICYCLIC IMIDAZOLE DERIVATIVES USEFUL AS TRPM8 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2017-11-15 EP disclosed
EP-2542552-A1 SUBSTITUTED AZA-BICYCLIC IMIDAZOLE DERIVATIVES USEFUL AS TRPM8 RECEPTOR MODULATORS Janssen Pharmaceutica, N.V. (BE) 2013-01-09 EP disclosed
WO-2011109587-A1 SUBSTITUTED AZA-BICYCLIC IMIDAZOLE DERIVATIVES USEFUL AS TRPM8 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-09-09 WO disclosed