SCHEMBL21737253

SCHEMBL21737253

CC(C)c1csc(F)c1Br

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32

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
SCHEMBL21479557 0.74
SCHEMBL26710139 0.70 CCR4 (0.31)
SCHEMBL6861223 0.69
SCHEMBL21737529 0.65 NPC1 (0.36) GABRA1GABRB1
SCHEMBL23890446 0.65 GABRA1 (0.30) GABRA1
SCHEMBL25129038 0.65
SCHEMBL29123073 0.65 GABRA1 (0.33) GABRA1GABRB1
SCHEMBL12565906 0.64 CA1 (0.32) GABRA1GABRB1
SCHEMBL19475121 0.64 GABRA1 (0.41) GABRA1GABRB1
SCHEMBL15979645 0.62

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-3611165-A1 PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT Mitsui Chemicals Agro, Inc. (JP) 2020-02-19 EP disclosed