SCHEMBL31024602

SCHEMBL31024602

C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](COC(F)F)O1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.41
▸ USP2 O75604 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ PDE4D Q08499 1/20 0.35
▸ RECQL P46063 1/20 0.33
▸ APLNR P35414 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ NAMPT P43490 1/20 0.33
▸ RORC P51449 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.32
▸ USP30 Q70CQ3 1/20 0.32
▸ HPGD P15428 1/20 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
SCHEMBL29239209 0.81 NR1H2 (0.54) NR1H2USP2SMN1; SMN2RECQLPDE4B
SCHEMBL16633063 0.81 NR1H2 (0.54) NR1H2USP2SMN1; SMN2RECQLPDE4B
SCHEMBL29017228 0.81 NR1H2 (0.54) NR1H2USP2SMN1; SMN2RECQLPDE4B
SCHEMBL16633062 0.81 NR1H2 (0.54) NR1H2USP2SMN1; SMN2RECQLPDE4B
SCHEMBL16633471 0.81 NR1H2 (0.54) NR1H2USP2SMN1; SMN2RECQLPDE4B
SCHEMBL24404847 0.81 NR1H2 (0.47) NR1H2USP2SMN1; SMN2RECQLNAMPT
SCHEMBL29017236 0.81 NR1H2 (0.54) NR1H2USP2SMN1; SMN2RECQLPDE4B
SCHEMBL21193259 0.81 NR1H2 (0.54) NR1H2USP2SMN1; SMN2RECQLPDE4B
SCHEMBL22078745 0.81 NR1H2 (0.54) NR1H2USP2SMN1; SMN2RECQLPDE4B
SCHEMBL16646451 0.81 NR1H2 (0.47) NR1H2USP2SMN1; SMN2RECQLNAMPT

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-2024173514-A1 AMIDE AND ESTER-SUBSTITUTED IMIDAZOPYRIDINE COMPOUNDS IDEAYA BIOSCIENCES, INC. (US) 2024-08-22 — — WO disclosed
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