SCHEMBL8306290

SCHEMBL8306290

CC(C)(C)OC(=O)ON(CCOc1cccc(C2=NC[C@@H](c3ccccc3)O2)c1F)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
P2RY1 P47900 1/20 0.31
PDK2 Q15119 1/20 0.31
SSTR4 P31391 1/20 0.30
F2 P00734 1/20 0.30
SLC6A9 P48067 1/20 0.30

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
SCHEMBL8303630 0.77 ALOX5AP (0.38) L3MBTL1KDM4EALDH1A1SMN1; SMN2
SCHEMBL8303628 0.77 ALOX5AP (0.38) L3MBTL1KDM4EALDH1A1SMN1; SMN2
SCHEMBL8308412 0.74 P2RY1 (0.33) P2RY1
SCHEMBL8304077 0.71 P2RY1 (0.37) KDM4EALDH1A1SMN1; SMN2P2RY1
SCHEMBL8304182 0.67 ALDH1A1 (0.35) L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL8304186 0.67 ALDH1A1 (0.35) L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL8303539 0.66 KDM1A (0.39) KDM4EALDH1A1SMN1; SMN2
SCHEMBL8303541 0.66 KDM1A (0.39) KDM4EALDH1A1SMN1; SMN2
SCHEMBL9405177 0.65 SLC6A2 (0.42) L3MBTL1
SCHEMBL7975735 0.62 L3MBTL1 (0.37) L3MBTL1KDM4E

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
EP-0832078-B1 N-HYDROXYUREAS AS ANTIINFLAMMATORY AGENTS PFIZER (US) 1999-10-20 EP disclosed
EP-0832078-A1 N-HYDROXYUREAS AS ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1998-04-01 EP disclosed
WO-1996040659-A1 N-HYDROXYUREAS AS ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1996-12-19 WO disclosed