SCHEMBL9566068

SCHEMBL9566068

O=C(O)N[C@@H]1CON(Cc2ccccc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
DRD4 P21917 2/20 0.42
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
RIPK1 Q13546 7/20 0.40

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
SCHEMBL18740602 0.89 KMT2A (0.43) KMT2ASMN1; SMN2MEN1
SCHEMBL18740533 0.88 HTT (0.41) RIPK1
SCHEMBL17224584 0.82 KMT2A (0.55) KMT2ADRD2
SCHEMBL17224647 0.77 GAA (0.32) RIPK1
SCHEMBL7846754 0.74 ALDH1A1 (0.42) KMT2ADRD4DRD2DRD3SMN1; SMN2
SCHEMBL18763395 0.74 GAA (0.43) KMT2ASMN1; SMN2MEN1
SCHEMBL18763261 0.72 KMT2A (0.40) KMT2ASMN1; SMN2MEN1
SCHEMBL2033656 0.72 RIPK1 (0.45) RIPK1
SCHEMBL18763112 0.71 KMT2A (0.43) KMT2ARIPK1
SCHEMBL18763097 0.71 KMT2A (0.43) KMT2ARIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0535645-A2 Carbamate derivatives of 4-amino-3-isoxazolidinones, 3-amino-1-hydroxypyrrolidin-2-ones and 1-amino-1-cyclopropanecarboxylic acid analogs, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-04-07 EP disclosed