SCHEMBL9848089

SCHEMBL9848089

C=CC(O)C(C)(C)CCn1cncn1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.39
ALDH1A1 P00352 4/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP19A1 P11511 2/20 0.34
UGT1A4 P22310 1/20 0.34
PDE4D Q08499 1/20 0.34
CYP3A4 P08684 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
FDPS P14324 1/20 0.33
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL28829940 0.87 FDPS (0.44) EGLN3ALDH1A1MAPTSMN1; SMN2CYP19A1
SCHEMBL9788437 0.76 EGLN3 (0.46) EGLN3ALDH1A1MAPTSMN1; SMN2CYP19A1
SCHEMBL10721461 0.73 EGLN3 (0.47) EGLN3ALDH1A1MAPTSMN1; SMN2CYP19A1
SCHEMBL10384282 0.72 EGLN3 (0.49) EGLN3ALDH1A1MAPTSMN1; SMN2CYP19A1
SCHEMBL3371124 0.70 EGLN3 (0.44) EGLN3ALDH1A1MAPTSMN1; SMN2CYP19A1
SCHEMBL8813815 0.68 EGLN3 (0.43) EGLN3CYP19A1FDPSHSP90AA1
SCHEMBL8468188 0.68 HSP90AA1 (0.49) EGLN3ALDH1A1MAPTSMN1; SMN2CYP19A1
SCHEMBL4550582 0.68 EGLN3 (0.50) EGLN3ALDH1A1MAPTSMN1; SMN2CYP19A1
SCHEMBL9848086 0.67 MEN1 (0.37) EGLN3ALDH1A1CYP19A1UGT1A4PDE4D
SCHEMBL13017117 0.66 EGLN3 (0.44) EGLN3ALDH1A1MAPTSMN1; SMN2CYP3A4

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-0405264-A1 Hydroxy-keto-azoles BAYER AG (DE) 1991-01-02 EP disclosed