SCHEMBL9201892

SCHEMBL9201892

CC(C)c1noc(C(=O)NC(C)(C)C)c1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.37
HPGD P15428 7/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 8/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
GFER P55789 1/20 0.33
KDM4E B2RXH2 2/20 0.33
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL9133628 0.87 LMNA (0.35) ALDH1A1SMN1; SMN2LMNAGAA
SCHEMBL9240927 0.81 GAA (0.38) ALDH1A1HPGDSMN1; SMN2LMNAL3MBTL1
SCHEMBL9201897 0.78 PRKAB2 (0.32) SMN1; SMN2
SCHEMBL8438550 0.77 NPC1 (0.45) ALDH1A1HPGDSMN1; SMN2HTTLMNA
SCHEMBL9198074 0.76 ALDH1A1 (0.35) ALDH1A1HPGDSMN1; SMN2HTTLMNA
SCHEMBL9581494 0.74 LMNA (0.31) ALDH1A1LMNA
SCHEMBL9596014 0.74 LMNA (0.36) ALDH1A1HPGDSMN1; SMN2HTTLMNA
SCHEMBL9203061 0.70 LMNA (0.48) ALDH1A1HPGDLMNAL3MBTL1KMT2A
SCHEMBL9201816 0.70 GAA (0.37) ALDH1A1HPGDSMN1; SMN2HTTLMNA
SCHEMBL9077424 0.70 LMNA (0.44) ALDH1A1HPGDSMN1; SMN2HTTLMNA

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
EP-0463444-B1 Dicarboxylic acid imides as herbicides BASF AG (DE) 1995-08-30 EP disclosed
US-5378680-A Dicarboximides and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 1995-01-03 US disclosed
US-5176739-A Plant growth regulators BASF AKTIENGESELLSCHAFT (DE) 1993-01-05 US disclosed
EP-0463444-A1 Dicarboxylic acid imides as herbicides BASF Aktiengesellschaft (DE) 1992-01-02 EP disclosed