SCHEMBL16957449

SCHEMBL16957449

C[C](C)c1cc(F)cc(OCCCl)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KAT6A Q92794 5/20 0.37
▸ HTR1A P08908 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33
▸ PLA2G2A P14555 1/20 0.33
▸ MAOB P27338 2/20 0.31
▸ LDHA P00338 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL16961265 0.85 KAT6A (0.35) KAT6AHTR1ADRD2HTR2ACYP4F2
SCHEMBL16962105 0.83 KAT6A (0.34) KAT6AHTR1ADRD2HTR2A
SCHEMBL16958183 0.83 PLA2G2A (0.46) KAT6APLA2G2A
SCHEMBL16962371 0.81 MAPT (0.44) PLA2G2A
SCHEMBL16957679 0.80 KAT6A (0.45) KAT6ACYP4F2CYP4A11MAOB
SCHEMBL16950724 0.76 FFAR4 (0.41) KAT6AMAOB
SCHEMBL16959539 0.74 KMT2A (0.50) MAOB
SCHEMBL16952046 0.74 CYP4F2 (0.51) CYP4F2CYP4A11
SCHEMBL16951713 0.74 ALDH1A1 (0.42) —
SCHEMBL4023626 0.73 SOD1 (0.40) DRD2

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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