SCHEMBL4583502

SCHEMBL4583502

C=C(C)CCC(=C)[C](C)C

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL83558 0.82
SCHEMBL16033752 0.80 HSD17B10 (0.37) HSD17B10TDP1
SCHEMBL22591341 0.75 HSD17B10 (0.33) HSD17B10TDP1
SCHEMBL646994 0.73
SCHEMBL517189 0.73 TET2 (0.39) HSD17B10TDP1
SCHEMBL8671294 0.69
SCHEMBL14540021 0.69
SCHEMBL11399369 0.67
SCHEMBL7116355 0.67 HSD17B10 (0.44) HSD17B10TDP1
SCHEMBL19402017 0.67

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1972623-A1 Arylpyridazines as fungicides Bayer CropScience AG (DE) 2008-09-24 EP disclosed
EP-1085807-B1 USE OF 2-(N-PHENYLAMINO)PYRIMIDINES AS FUNGICIDES, AND NOVEL 2-(N-PHENYLAMINO)PYRIMIDINES BASF AG (DE) 2003-05-07 EP disclosed