SCHEMBL31510697

SCHEMBL31510697

CC(C)(C)OC(=O)N1CC=C(N2CCCCC2)C(F)(F)C1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.40
▸ PDK2 Q15119 1/20 0.36
▸ GPR119 Q8TDV5 4/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ABL1 P00519 1/20 0.36
▸ RIN1 Q13671 1/20 0.36
▸ PDK4 Q16654 1/20 0.36
▸ EPHX1 P07099 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GRM5 P41594 2/20 0.35
▸ GRM1 Q13255 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ NR1H2 P55055 1/20 0.34

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
SCHEMBL25322440 0.99 HPGD (0.38) HPGDPDK2GPR119MEN1KMT2A
SCHEMBL25268489 0.86 GPR119 (0.42) GPR119MAPT
SCHEMBL31161550 0.81 OXTR (0.35) PDK2GPR119MEN1KMT2APDK4
SCHEMBL27241629 0.79 ACHE (0.43) PDK2GPR119MEN1KMT2ASMN1; SMN2
SCHEMBL25845989 0.78 NR1H2 (0.39) GPR119MEN1KMT2AUSP2SMN1; SMN2
SCHEMBL24880988 0.78 GRM5 (0.39) GPR119MEN1KMT2AUSP2SMN1; SMN2
SCHEMBL31278957 0.77 NR1H2 (0.36) PDK2GPR119USP2SMN1; SMN2PDK4
SCHEMBL30255499 0.76 ALDH1A1 (0.49) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL31334607 0.76 USP30 (0.36) USP2SMN1; SMN2PDK4MAPTALDH1A1
SCHEMBL25934615 0.76 ESR2 (0.47) PDK2NR1H2

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-2025066935-A1 COMPOUNDS, COMPOSITIONS AND METHODS THEREOF HEPAITECH (BEIJING) BIOPHARMA TECHNOLOGY CO., LTD. (CN) 2025-04-03 — — WO disclosed
Send feedback