SCHEMBL21894433

SCHEMBL21894433

Cn1nc2c(c1-c1cc(F)c(F)c(F)c1)CCN(C(=O)c1cnn(C(C)(C)C)c1C(F)(F)F)C2

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 12/20 0.59
▸ P2RX7 Q99572 7/20 0.49
▸ DPP4 P27487 1/20 0.39
▸ DPP8 Q6V1X1 1/20 0.39
▸ DPP7 Q9UHL4 1/20 0.39

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
SCHEMBL21893503 0.91 MGLL (0.56) MGLLP2RX7DPP4DPP8DPP7
SCHEMBL21893816 0.86 MGLL (0.52) MGLLP2RX7
SCHEMBL21893992 0.82 MGLL (0.55) MGLLP2RX7
SCHEMBL21818446 0.81 MGLL (0.64) MGLL
SCHEMBL21818448 0.81 MGLL (0.64) MGLL
SCHEMBL21893986 0.80 MGLL (0.56) MGLLP2RX7DPP4DPP8DPP7
SCHEMBL21894457 0.80 MGLL (0.48) MGLLP2RX7DPP4DPP8DPP7
SCHEMBL21894461 0.79 P2RX7 (0.46) MGLLP2RX7
SCHEMBL21893950 0.79 MGLL (0.60) MGLLP2RX7
SCHEMBL21893860 0.79 MGLL (0.58) 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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