SCHEMBL9201897

SCHEMBL9201897

CC(C)c1noc(C(=O)NC(C)(C)C)c1OC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 1/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA2 P54646 1/20 0.32
PRKAA1 Q13131 1/20 0.32
PRKAG3 Q9UGI9 1/20 0.32
PRKAG2 Q9UGJ0 1/20 0.32
PRKAB1 Q9Y478 1/20 0.32
NPY1R P25929 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GABRA5 P31644 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
SCHEMBL9581494 0.88 LMNA (0.31)
SCHEMBL9526216 0.81 ALDH1A1 (0.37) NPY1RSMN1; SMN2GABRA5
SCHEMBL8438552 0.78 SMN1; SMN2 (0.42) SMN1; SMN2GABRA5
SCHEMBL9201892 0.78 ALDH1A1 (0.37) SMN1; SMN2
SCHEMBL9198077 0.78 NPY1R (0.30) NPY1RSMN1; SMN2GABRA5
SCHEMBL9133628 0.74 LMNA (0.35) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL9203070 0.72 GABRA5 (0.38) GABRA5
SCHEMBL9200634 0.72 KDM4E (0.35) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL8986729 0.71 SMN1; SMN2 (0.40) SMN1; SMN2
SCHEMBL8435850 0.69 MAPK14 (0.33)

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
EP-0463444-B1 Dicarboxylic acid imides as herbicides BASF AG (DE) 1995-08-30 EP disclosed
EP-0463444-A1 Dicarboxylic acid imides as herbicides BASF Aktiengesellschaft (DE) 1992-01-02 EP disclosed