SCHEMBL8478922

SCHEMBL8478922

CC(C)(C)ON=O.CCOC(=O)c1csc(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.50
NPC1 O15118 6/20 0.50
MAPT P10636 6/20 0.50
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAOA P21397 2/20 0.46
MAOB P27338 2/20 0.46
SMN1; SMN2 Q16637 5/20 0.44
GAA P10253 3/20 0.44
POLB P06746 1/20 0.43
PKM P14618 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
EGFR P00533 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ABCB1 P08183 1/20 0.43
HSP90AA1 P07900 2/20 0.42

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
SCHEMBL691101 0.86 RAB9A (0.64) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL20951358 0.77 HPGDS (0.52) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL8485222 0.75 CDC7 (0.46) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL14207145 0.74 RAB9A (0.52) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL9454202 0.73 RAB9A (0.66) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL1421878 0.72 RAB9A (0.60) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL10465943 0.72 MAPT (0.45) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL13144514 0.71 MAPT (0.70) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL914552 0.71 RAB9A (0.68) RAB9ANPC1MAPTALDH1A1MEN1
SCHEMBL14292709 0.71 RAB9A (0.63) RAB9ANPC1MAPTALDH1A1MEN1

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
WO-1999018102-A1 FUNGICIDAL AND ARTHROPODICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-04-15 WO disclosed