SCHEMBL10733504

SCHEMBL10733504

CCOC(=O)C1C(=O)N(CC)c2c(C(C)=O)cccc21

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
MAPT P10636 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 1/20 0.36
KDM4E B2RXH2 2/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 1/20 0.35
ATM Q13315 1/20 0.35
LMNA P02545 3/20 0.34
CREBBP Q92793 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP2 O95551 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
ALOX15 P16050 1/20 0.33

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
SCHEMBL10732659 0.90 ALDH1A1 (0.39) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL10741876 0.86 CREBBP (0.38) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL2743830 0.78 ALDH1A1 (0.47) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL9667484 0.72 TDP2 (0.48) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL10746773 0.71 ALDH1A1 (0.40) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL6693673 0.68 ALDH1A1 (0.41) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL10733388 0.68 MEN1 (0.43) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL7236050 0.67 ALDH1A1 (0.45) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL11789560 0.66 CYP1A2 (0.45) ALDH1A1MAPTL3MBTL1TSHRKDM4E
SCHEMBL11797014 0.65 HTT (0.48) ALDH1A1MAPTTSHRKDM4EKMT2A

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
US-4686224-A Oxindole antiinflammatory agents PFIZER INC. (US) 1987-08-11 US disclosed
US-4644005-A ANTIARTHRITIC AGENTS PFIZER INC. (US) 1987-02-17 US disclosed