SCHEMBL21893715

SCHEMBL21893715

Cn1nc2c(c1-c1ccc(C(F)(F)F)cc1)CCN(C(=O)c1ccc3ncccc3c1)C2

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 7/20 0.50
▸ MGLL Q99685 10/20 0.48
▸ TRPM8 Q7Z2W7 1/20 0.48
▸ PRLHR P49683 2/20 0.45

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
SCHEMBL21893677 0.92 P2RX7 (0.51) P2RX7MGLL
SCHEMBL21818705 0.89 MGLL (0.56) P2RX7MGLL
SCHEMBL21894038 0.89 MGLL (0.46) P2RX7MGLL
SCHEMBL21893738 0.89 P2RX7 (0.50) P2RX7MGLL
SCHEMBL21894510 0.88 P2RX7 (0.47) P2RX7MGLL
SCHEMBL21819385 0.87 MGLL (0.58) P2RX7MGLL
SCHEMBL21893633 0.87 MGLL (0.47) P2RX7MGLL
SCHEMBL21893581 0.86 MGLL (0.59) MGLL
SCHEMBL21894047 0.86 P2RX7 (0.49) P2RX7MGLL
SCHEMBL23872235 0.86 P2RX7 (0.46) P2RX7MGLLTRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020065613-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 — — WO disclosed
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