SCHEMBL30877175

SCHEMBL30877175

CCOC(=O)C(=O)CCC1CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.42
MAPT P10636 1/20 0.39
GAA P10253 1/20 0.37
ALDH1A1 P00352 5/20 0.36
NPSR1 Q6W5P4 1/20 0.35
GLO1 Q04760 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
METAP2 P50579 1/20 0.35
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
USP2 O75604 1/20 0.34
ALOX15 P16050 1/20 0.34
HPGD P15428 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
SCHEMBL7362812 0.92 METAP2 (0.42) FAAHMAPTALDH1A1L3MBTL1METAP2
SCHEMBL7280876 0.91 HSD11B1 (0.44) FAAHMAPTALDH1A1L3MBTL1METAP2
SCHEMBL16761652 0.85 NAAA (0.36) FAAHMAPTGAAALDH1A1L3MBTL1
SCHEMBL7641554 0.80 CYP1A2 (0.46) FAAHMETAP2
SCHEMBL18623243 0.79 ALDH1A1 (0.50) MAPTGAAALDH1A1L3MBTL1LMNA
SCHEMBL113236 0.79 MAPT (0.41) FAAHMAPTGAAALDH1A1NPSR1
SCHEMBL16046274 0.78 FAAH (0.53) FAAHMAPTGAAALDH1A1NPSR1
SCHEMBL23458431 0.77 METAP2 (0.34) MAPTGAAALDH1A1NPSR1L3MBTL1
SCHEMBL28583412 0.76 GPR119 (0.42) FAAHMAPTGAAALDH1A1TSHR
SCHEMBL25062701 0.76 METAP2 (0.41) MAPTALDH1A1L3MBTL1METAP2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024067708-A1 AMMONIUM OXALATE DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PHARMACEUTICAL USE OF SAME 苏州阿尔脉生物科技有限公司 2024-04-04 WO disclosed
CN-117800895-A Oxalic acid amine derivative, pharmaceutical composition containing oxalic acid amine derivative and medical application of oxalic acid amine derivative 苏州阿尔脉生物科技有限公司 2024-04-02 CN disclosed