SCHEMBL10520787

SCHEMBL10520787

Cc1c(C(=O)Nc2cccc(OC(C)C)c2)cccc1[N+](=O)[O-]

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.66
▸ LMNA P02545 4/20 0.66
▸ L3MBTL1 Q9Y468 1/20 0.66
▸ MEN1 O00255 6/20 0.63
▸ DHODH Q02127 1/20 0.63
▸ RAB9A P51151 3/20 0.60
▸ NPC1 O15118 1/20 0.60
▸ ALDH1A1 P00352 1/20 0.60
▸ PKM P14618 1/20 0.60
▸ SMN1; SMN2 Q16637 4/20 0.60
▸ GAA P10253 1/20 0.58
▸ GLA P06280 1/20 0.57
▸ CYP2C9 P11712 1/20 0.57
▸ MAPT P10636 3/20 0.54
▸ HTT P42858 1/20 0.53

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
SCHEMBL11453866 0.90 KMT2A (0.64) KMT2ALMNAL3MBTL1MEN1RAB9A
SCHEMBL8711203 0.81 RAB9A (0.74) KMT2ALMNAMEN1RAB9ANPC1
SCHEMBL27504229 0.80 RAB9A (0.67) KMT2ALMNAL3MBTL1MEN1RAB9A
Mepronil SCHEMBL18447 0.78 KCNK3 (0.67) KMT2AMEN1RAB9ANPC1ALDH1A1
Mepronil SCHEMBL20522512 0.78 KCNK3 (0.67) KMT2AMEN1RAB9ANPC1ALDH1A1
Mepronil SCHEMBL29453871 0.78 KCNK3 (0.67) KMT2AMEN1RAB9ANPC1ALDH1A1
Mepronil SCHEMBL30731287 0.78 KCNK3 (0.67) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL11502297 0.78 KCNK3 (0.50) KMT2ALMNAMEN1RAB9ANPC1
SCHEMBL18120561 0.78 DHODH (1.00) KMT2ALMNAL3MBTL1MEN1DHODH
SCHEMBL29282077 0.77 MEN1 (0.65) KMT2ALMNAMEN1RAB9AALDH1A1

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
JP-1071843-A — — None — — JP disclosed
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