SCHEMBL16957800

SCHEMBL16957800

[CH2]c1cc(C#N)ccc1OC(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EIF4E P06730 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39
▸ AR P10275 4/20 0.37
▸ IRAK4 Q9NWZ3 1/20 0.37
▸ SLC6A9 P48067 2/20 0.36
▸ ALK Q9UM73 1/20 0.36
▸ XDH P47989 2/20 0.36
▸ KCNH2 Q12809 1/20 0.35
▸ BRPF1 P55201 1/20 0.35
▸ UGCG Q16739 1/20 0.33
▸ CSNK2A1 P68400 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33

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
SCHEMBL16955678 0.82 SLC22A12 (0.36) AR
SCHEMBL10088433 0.80 AR (0.44) EIF4EMKNK1MKNK2ARIRAK4
SCHEMBL21079169 0.80 XDH (0.49) XDHALDH1A1
SCHEMBL7667086 0.79 AR (0.51) ARALDH1A1
SCHEMBL16954818 0.79 ALK (0.39) EIF4EMKNK1MKNK2ARIRAK4
SCHEMBL16952112 0.79 IRAK4 (0.38) EIF4EMKNK1MKNK2ARIRAK4
SCHEMBL16954817 0.79 XDH (0.40) EIF4EMKNK1MKNK2ARIRAK4
SCHEMBL6114176 0.79 POLB (0.43) EIF4EMKNK1MKNK2ARIRAK4
SCHEMBL524718 0.79 SLC6A9 (0.45) EIF4EMKNK1MKNK2ARIRAK4
SCHEMBL177602 0.79 TTR (0.42) EIF4EMKNK1MKNK2ARIRAK4

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-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 — — EP disclosed
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