SCHEMBL31444184

SCHEMBL31444184

CC(C)(C)OC(=O)N1CC=C(c2ccc(-c3ccc(OCc4ccccc4)nc3OCc3ccccc3)cc2N)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 1/20 0.47
▸ TNK2 Q07912 1/20 0.45
▸ PDK4 Q16654 1/20 0.45
▸ GRM5 P41594 4/20 0.43
▸ GRM1 Q13255 4/20 0.43
▸ NAMPT P43490 1/20 0.42
▸ HTR6 P50406 1/20 0.42
▸ LNPEP Q9UIQ6 1/20 0.41
▸ PDE10A Q9Y233 1/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ GPR119 Q8TDV5 2/20 0.40
▸ EED O75530 1/20 0.39
▸ RBBP4 Q09028 1/20 0.39
▸ SUZ12 Q15022 1/20 0.39
▸ EZH2 Q15910 1/20 0.39
▸ WNT3A P56704 1/20 0.39
▸ ATR Q13535 1/20 0.39
▸ PRMT5 O14744 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
SCHEMBL31443829 0.92 PDK4 (0.46) BTKTNK2PDK4GRM5GRM1
SCHEMBL23301215 0.91 NAMPT (0.49) BTKTNK2PDK4GRM5GRM1
SCHEMBL29197745 0.91 PDK4 (0.45) BTKTNK2PDK4GRM5GRM1
SCHEMBL31630894 0.91 PDK4 (0.45) BTKTNK2PDK4GRM5GRM1
SCHEMBL31607858 0.90 PDK4 (0.47) BTKTNK2PDK4GRM5GRM1
SCHEMBL30201557 0.87 WNT3A (0.48) BTKTNK2PDK4GRM5GRM1
SCHEMBL25143682 0.87 WNT3A (0.48) BTKTNK2PDK4GRM5GRM1
SCHEMBL24880538 0.85 PDK4 (0.46) BTKPDK4GRM5GRM1HTR6
SCHEMBL30112411 0.85 PDK4 (0.46) BTKPDK4GRM5GRM1HTR6
SCHEMBL30511793 0.84 PDK4 (0.45) BTKTNK2PDK4GRM5GRM1

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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