SCHEMBL27834704

SCHEMBL27834704

NC(=O)O[CH]c1ccccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 2/20 0.46
▸ GRIN3B O60391 2/20 0.46
▸ GRIN1 Q05586 2/20 0.46
▸ GRIN2A Q12879 2/20 0.46
▸ GRIN2B Q13224 2/20 0.46
▸ GRIN2C Q14957 2/20 0.46
▸ GRIN3A Q8TCU5 2/20 0.46
▸ NFE2L2 Q16236 5/20 0.45
▸ MAOB P27338 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CYP1A2 P05177 4/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CYP2D6 P10635 1/20 0.38
▸ CYP1B1 Q16678 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
SCHEMBL6959644 0.81 CYP1A2 (0.46) NFE2L2MAOBALDH1A1CYP1A2CYP2C19
SCHEMBL4336607 0.75 NFE2L2 (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7145179 0.74 GRIN2D (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL27815053 0.74 NFE2L2 (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL27834682 0.73 GAA (0.40) ALDH1A1CYP1A2CYP2C9SMN1; SMN2
SCHEMBL27834761 0.71 MAPT (0.43) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL7001308 0.71 NFE2L2 (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29244501 0.71 NFE2L2 (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1379800 0.71 NFE2L2 (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30560953 0.71 NFE2L2 (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
CN-102137841-A Ortho-substituted haloalkylsulfonanilide derivative and herbicide NISSAN CHEMICAL IND LTD 2011-07-27 — — CN disclosed
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