SCHEMBL16957671

SCHEMBL16957671

CC(=O)Oc1cc(C)cc(CC(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.46
▸ CYP4F2 P78329 1/20 0.45
▸ CYP4A11 Q02928 1/20 0.45
▸ ELANE P08246 1/20 0.40
▸ SLC7A5 Q01650 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ TP53 P04637 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ TTR P02766 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PTGS2 P35354 1/20 0.38
▸ CYP19A1 P11511 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ GLA P06280 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ CASP1 P29466 2/20 0.36
▸ CASP7 P55210 2/20 0.36

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
SCHEMBL17749145 0.84 ALOX15 (0.44) ELANESLC7A5KDM4EKMT2AMEN1
SCHEMBL16953162 0.83 CYP4F2 (0.61) LMNACYP4F2CYP4A11KDM4EKMT2A
SCHEMBL17749092 0.83 THRB (0.42) LMNASLC7A5KMT2ASMN1; SMN2PTGS2
SCHEMBL10149317 0.82 LMNA (0.52) LMNACYP4F2CYP4A11ELANEKDM4E
SCHEMBL16956887 0.82 CYP4F2 (0.44) LMNACYP4F2CYP4A11ELANEKDM4E
SCHEMBL16957669 0.82 CYP4F2 (0.44) LMNACYP4F2CYP4A11KDM4EKMT2A
SCHEMBL16546897 0.81 CYP4F2 (0.67) LMNACYP4F2CYP4A11ELANEKDM4E
SCHEMBL16952285 0.81 LMNA (0.50) LMNACYP4F2CYP4A11ELANEKDM4E
SCHEMBL16956888 0.80 CYP4F2 (0.42) LMNACYP4F2CYP4A11KDM4EKMT2A
SCHEMBL16953159 0.80 LMNA (0.43) LMNACYP4F2CYP4A11KDM4EKMT2A

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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