SCHEMBL30755349

SCHEMBL30755349

CC(C)(C)OC(=O)c1c(C2CCC(F)(F)CC2)ccc(F)c1CBr

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.36
▸ SCN9A Q15858 5/20 0.33
▸ SCN5A Q14524 2/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ IDH1 O75874 1/20 0.33
▸ IDH2 P48735 1/20 0.33
▸ TRPV3 Q8NET8 3/20 0.32
▸ ALOX5AP P20292 1/20 0.32
▸ FEN1 P39748 1/20 0.32
▸ IL1B P01584 2/20 0.31
▸ P2RX7 Q99572 2/20 0.31

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
SCHEMBL27377777 1.00 GPR119 (0.36) GPR119SCN9ASCN5ACNR1CNR2
SCHEMBL30755381 0.88 P2RX7 (0.35) IL1BP2RX7
SCHEMBL27379422 0.88 P2RX7 (0.35) IL1BP2RX7
SCHEMBL30755526 0.87 NR1H2 (0.34) SCN9AIDH1IDH2IL1BP2RX7
SCHEMBL27379106 0.87 NR1H2 (0.34) SCN9AIDH1IDH2IL1BP2RX7
SCHEMBL30755433 0.85 HDAC4 (0.36) GPR119SCN9ASCN5AIDH1IDH2
SCHEMBL27379299 0.85 HDAC4 (0.36) GPR119SCN9ASCN5AIDH1IDH2
SCHEMBL27374381 0.84 MEN1 (0.35) GPR119SCN9ASCN5ACNR2IDH1
SCHEMBL27375857 0.81 MEN1 (0.36) IDH1IDH2IL1BP2RX7
SCHEMBL27375374 0.81 ALOX5AP (0.31) GPR119SCN9ASCN5ACNR2IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4562016-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2025-06-04 — — EP disclosed
WO-2024026483-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 — — WO disclosed
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