SCHEMBL20399335

SCHEMBL20399335

CC1(C)OB(C2=CC3(CCN(C(=O)O)CC3)OC2)OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.33
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL20412560 0.82 P2RX7 (0.37) P2RX7MAPK1
SCHEMBL31387272 0.79 P2RX7 (0.44) P2RX7MAPK1
SCHEMBL3710492 0.70 OPRD1 (0.42) —
SCHEMBL3710496 0.70 OPRD1 (0.42) —
SCHEMBL378063 0.70 P2RX7 (0.46) P2RX7MAPK1
SCHEMBL20606348 0.70 P2RX7 (0.54) P2RX7MAPK1
SCHEMBL1441509 0.70 P2RX7 (0.46) P2RX7MAPK1
SCHEMBL370271 0.69 P2RX7 (0.41) P2RX7MAPK1
SCHEMBL986716 0.68 P2RX7 (0.51) P2RX7MAPK1
SCHEMBL23243025 0.67 — —

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-2018134695-A1 1,1,1-TRIFLUORO-3-HYDROXYPROPAN-2-YL CARBAMATE DERIVATIVES AS MAGL INHIBITORS PFIZER INC. (US) 2018-07-26 — — WO disclosed
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