SCHEMBL28976958

SCHEMBL28976958

O=C1CC(C(=O)OCc2ccccc2)CN1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
TDP1 Q9NUW8 1/20 0.46
GLA P06280 1/20 0.45
TSHR P16473 1/20 0.45
HTR2C P28335 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
FABP7 O15540 1/20 0.44
FABP5 Q01469 1/20 0.44
ATM Q13315 1/20 0.44
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
ALDH1A1 P00352 2/20 0.44
ELANE P08246 2/20 0.43

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
SCHEMBL4967343 0.86 HPGD (0.47) HPGDTDP1GLATSHRL3MBTL1
SCHEMBL5220501 0.80 HTR2C (0.57) HPGDTDP1TSHRHTR2CL3MBTL1
SCHEMBL795756 0.80 HPGD (0.54) HPGDTDP1TSHRL3MBTL1FABP7
SCHEMBL6666657 0.77 FABP7 (0.58) HPGDTDP1TSHRL3MBTL1FABP7
SCHEMBL9002126 0.77 ALDH1A1 (0.60) HPGDTDP1TSHRL3MBTL1FABP7
SCHEMBL10917021 0.77 FABP7 (0.58) HPGDTDP1TSHRL3MBTL1FABP7
SCHEMBL17391194 0.77 ALDH1A1 (0.60) HPGDTDP1TSHRL3MBTL1FABP7
SCHEMBL280126 0.77 FABP7 (0.58) HPGDTDP1TSHRL3MBTL1FABP7
SCHEMBL17390977 0.77 ALDH1A1 (0.60) HPGDTDP1TSHRL3MBTL1FABP7
SCHEMBL17390980 0.77 ALDH1A1 (0.60) HPGDTDP1TSHRL3MBTL1FABP7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110218169-B Synthesis method of chiral 4- (N-benzyloxycarbonyl) pyrrolidone 重庆医科大学 2023-03-28 CN claimed
CN-110218169-B Synthesis method of chiral 4- (N-benzyloxycarbonyl) pyrrolidone 重庆医科大学 2023-03-28 CN disclosed
CN-110218169-B Synthesis method of chiral 4- (N-benzyloxycarbonyl) pyrrolidone 重庆医科大学 2023-03-28 CN disclosed
CN-110218169-B Synthesis method of chiral 4- (N-benzyloxycarbonyl) pyrrolidone 重庆医科大学 2023-03-28 CN disclosed