SCHEMBL24896997

SCHEMBL24896997

CCc1cn(C[C@H](O)CO)nc1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRIA2 P42262 14/20 0.36
▸ P2RX7 Q99572 2/20 0.34
▸ GRM1 Q13255 2/20 0.33
▸ JAK2 O60674 3/20 0.32
▸ JAK1 P23458 3/20 0.32
▸ TYK2 P29597 3/20 0.32
▸ JAK3 P52333 3/20 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
SCHEMBL24897004 0.85 GRIA2 (0.36) GRIA2P2RX7GRM1
SCHEMBL26452701 0.79 JAK2 (0.34) JAK2JAK1TYK2JAK3
SCHEMBL24240629 0.77 L3MBTL1 (0.40) GRIA2P2RX7GRM1
SCHEMBL12871753 0.74 GRIA2 (0.35) GRIA2P2RX7GRM1
SCHEMBL13930388 0.71 GRIA2 (0.45) GRIA2P2RX7GRM1
SCHEMBL24112467 0.71 GRIA2 (0.33) GRIA2P2RX7GRM1
SCHEMBL24896999 0.70 LRRK2 (0.41) GRIA2P2RX7GRM1
SCHEMBL805427 0.69 GAA (0.44) GRIA2
SCHEMBL15723735 0.68 NTRK1 (0.37) GRIA2
SCHEMBL24897003 0.68 IRAK4 (0.41) GRIA2P2RX7GRM1

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-2023285497-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS ANTIBIOTICS F. HOFFMANN-LA ROCHE AG (CH) 2023-01-19 — — WO disclosed
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