SCHEMBL31460700

SCHEMBL31460700

CNC[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 1/20 0.52
▸ DRD2 P14416 6/20 0.46
▸ KDM1A O60341 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ CTSK P43235 2/20 0.43
▸ KMT2A Q03164 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ EPHX1 P07099 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ GAA P10253 1/20 0.38

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
SCHEMBL2395381 0.91 DRD2 (0.48) BTKDRD2KDM1AMAOBCTSK
SCHEMBL2395376 0.91 DRD2 (0.48) BTKDRD2KDM1AMAOBCTSK
SCHEMBL3906349 0.84 BTK (0.55) BTKDRD2KDM1AMAOBCTSK
SCHEMBL19156343 0.84 BTK (0.55) BTKDRD2KDM1AMAOBCTSK
SCHEMBL19156113 0.84 BTK (0.55) BTKDRD2KDM1AMAOBCTSK
SCHEMBL24448866 0.84 BTK (0.55) BTKDRD2KDM1AMAOBCTSK
SCHEMBL1155174 0.84 BTK (0.55) BTKDRD2KDM1AMAOBCTSK
SCHEMBL3901032 0.84 BTK (0.55) BTKDRD2KDM1AMAOBCTSK
SCHEMBL12424470 0.84 BTK (0.55) BTKDRD2KDM1AMAOBCTSK
SCHEMBL3903151 0.84 BTK (0.55) BTKDRD2KDM1AMAOBCTSK

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-2025076441-A1 COMPOUNDS OF GCN2 MODULATORS Alesta Therapeutics BV (NL) 2025-04-10 — — WO disclosed
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