SCHEMBL20640863

SCHEMBL20640863

N/C(=N\O)c1ccc(C/C(N)=N\O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.44
▸ GAA P10253 2/20 0.44
▸ KDM1A O60341 3/20 0.44
▸ LMNA P02545 3/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ TP53 P04637 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ GFER P55789 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HDAC1 Q13547 3/20 0.38
▸ HDAC2 Q92769 3/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL20640865 1.00 RAB9A (0.44) RAB9AGAAKDM1ALMNANPC1
SCHEMBL20645658 1.00 RAB9A (0.44) RAB9AGAAKDM1ALMNANPC1
SCHEMBL3462585 0.80 CA2 (0.50) RAB9AGAALMNANPC1HSD17B10
SCHEMBL3462583 0.80 CA2 (0.50) RAB9AGAALMNANPC1HSD17B10
SCHEMBL28329860 0.80 ALDH1A1 (0.48) GAAMAPTTP53USP2POLB
SCHEMBL21223499 0.80 CA2 (0.50) RAB9AGAALMNANPC1HSD17B10
SCHEMBL2733920 0.80 ALDH1A1 (0.48) GAAMAPTTP53USP2POLB
SCHEMBL28597959 0.80 ALDH1A1 (0.48) GAAMAPTTP53USP2POLB
SCHEMBL21215222 0.79 KDM1A (0.60) RAB9AGAAKDM1ALMNANPC1
SCHEMBL838151 0.78 CA2 (0.56) KMT2AL3MBTL1HDAC1HDAC2KDM4E

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-2019012011-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2019-01-17 — — WO disclosed
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