SCHEMBL31444234

SCHEMBL31444234

CC(C)(C)OC(=O)N1CC=C(c2ccc(N3CCC(=O)NC3=O)cc2O)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK4 Q16654 1/20 0.51
▸ CNR1 P21554 2/20 0.47
▸ GRM1 Q13255 8/20 0.45
▸ GRM5 P41594 7/20 0.45
▸ JAK1 P23458 1/20 0.45
▸ GABRP O00591 1/20 0.44
▸ GABRD O14764 1/20 0.44
▸ GABRA1 P14867 1/20 0.44
▸ GABRB1 P18505 1/20 0.44
▸ GABRG2 P18507 1/20 0.44
▸ GABRB3 P28472 1/20 0.44
▸ GABRA5 P31644 1/20 0.44
▸ GABRA3 P34903 1/20 0.44
▸ GABRA2 P47869 1/20 0.44
▸ GABRB2 P47870 1/20 0.44
▸ GABRA4 P48169 1/20 0.44
▸ GABRE P78334 1/20 0.44
▸ GABRA6 Q16445 1/20 0.44
▸ GABRG1 Q8N1C3 1/20 0.44
▸ GABRG3 Q99928 1/20 0.44

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
SCHEMBL23120656 0.87 NAMPT (0.52) PDK4CNR1GRM1GRM5JAK1
SCHEMBL30913581 0.84 PDK4 (0.51) PDK4CNR1GRM1GRM5DDB1
SCHEMBL25167744 0.84 PDK4 (0.51) PDK4CNR1GRM1GRM5DDB1
SCHEMBL12713080 0.80 PDK4 (0.58) PDK4CNR1GRM1GRM5JAK1
SCHEMBL31443584 0.78 PDK4 (0.56) PDK4CNR1GRM1GRM5JAK1
SCHEMBL30952401 0.78 NAMPT (0.47) PDK4CNR1GRM1GRM5JAK1
SCHEMBL31444063 0.77 KDM4E (0.47) DDB1CRBN
SCHEMBL24319286 0.77 GRM1 (0.47) PDK4CNR1GRM1GRM5DDB1
SCHEMBL29506996 0.76 NR1H2 (0.63) DDB1CRBN
SCHEMBL26844994 0.76 NR1H2 (0.63) DDB1CRBN

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-2025096856-A1 COVALENT CEREBLON LIGANDS C4 THERAPEUTICS, INC. (US) 2025-05-08 — — WO disclosed
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