Azetidine

Azetidine

SCHEMBL28757441

C1CNC1.CCCCCCCCOC(=O)c1cc(CCCCCCCC)ccc1C(=O)O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 2/20 0.54
PPARA Q07869 2/20 0.54
PPARG P37231 1/20 0.54
TSHR P16473 3/20 0.49
ALDH1A1 P00352 3/20 0.49
LMNA P02545 2/20 0.49
RARB P10826 3/20 0.47
RARA P10276 1/20 0.47
RARG P13631 1/20 0.47
MAPK1 P28482 2/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
Octane SCHEMBL28824317 0.93 KAT8 (0.62) KAT8PPARAPPARGTSHRALDH1A1
SCHEMBL9420871 0.93 KAT8 (0.62) KAT8PPARAPPARGTSHRALDH1A1
Cyclohexane SCHEMBL27580700 0.92 KAT8 (0.58) KAT8PPARAPPARGTSHRALDH1A1
Pentane SCHEMBL27636475 0.92 KAT8 (0.60) KAT8PPARAPPARGTSHRALDH1A1
Thiazolidine SCHEMBL28228791 0.88 PPARA (0.47) KAT8PPARAPPARGTSHRALDH1A1
Octane SCHEMBL28857502 0.88 KAT8 (0.62) KAT8PPARAPPARGTSHRALDH1A1
Hexane SCHEMBL28050986 0.88 KAT8 (0.62) KAT8PPARAPPARGTSHRALDH1A1
SCHEMBL182437 0.88 KAT8 (0.62) KAT8PPARAPPARGTSHRALDH1A1
Naphthalene SCHEMBL27271514 0.87 TSHR (0.57) KAT8PPARAPPARGTSHRALDH1A1
SCHEMBL27857274 0.87 TSHR (0.57) KAT8PPARAPPARGTSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101249091-A Target for therapy of cognitive impairment UNIV JOHNS HOPKINS (US) 2008-08-27 CN disclosed
CN-101249090-A Target for theraphy of cognitive impairment UNIV JOHNS HOPKINS (US) 2008-08-27 CN disclosed
CN-1829804-A Target sites for treatment of cognitive dysfunction UNIV JOHNS HOPKINS (US) 2006-09-06 CN disclosed