SCHEMBL21893960

SCHEMBL21893960

COc1ccc(C(=O)N2CCc3c(nn(C)c3-c3cc(F)c(F)c(F)c3)C2)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.56
▸ CPS1 P31327 9/20 0.53
▸ P2RX7 Q99572 5/20 0.48

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
SCHEMBL21893764 0.89 MGLL (0.55) MGLLP2RX7
SCHEMBL21893969 0.87 MGLL (0.60) MGLLP2RX7
SCHEMBL21893593 0.86 MGLL (0.58) MGLLP2RX7
SCHEMBL21894454 0.85 MGLL (0.57) MGLLP2RX7
SCHEMBL21893579 0.85 P2RX7 (0.55) MGLLP2RX7
SCHEMBL21894447 0.84 P2RX7 (0.47) MGLLP2RX7
SCHEMBL21893613 0.84 P2RX7 (0.44) MGLLP2RX7
SCHEMBL21893825 0.84 MGLL (0.61) MGLLP2RX7
SCHEMBL21893544 0.84 MGLL (0.48) MGLLP2RX7
SCHEMBL21893787 0.84 MGLL (0.50) MGLLP2RX7

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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