SCHEMBL8699707

SCHEMBL8699707

C[CH]C(C)SC1CCCCCC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 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
SCHEMBL8702644 1.00 ADH1B (0.30) ADH1BADH1CADH1A
SCHEMBL8704648 0.93
SCHEMBL11809131 0.79 ADH1C (0.38) ADH1BADH1CADH1A
SCHEMBL105844 0.74 SLC2A1 (0.31) ADH1BADH1CADH1A
SCHEMBL15270726 0.74 SLC2A1 (0.31) ADH1BADH1CADH1A
SCHEMBL13081808 0.71
SCHEMBL8699020 0.70
SCHEMBL7471909 0.70 ADH1B (0.32) ADH1BADH1CADH1A
SCHEMBL7482713 0.70
SCHEMBL7479908 0.68 SLC2A1 (0.32)

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
WO-1998007720-A1 SUBSTITUTED 2-ARYLPYRIDINE AS HERBICIDE BASF AKTIENGESELLSCHAFT (DE) 1998-02-26 WO disclosed