SCHEMBL8167991

SCHEMBL8167991

CC(C)(F)c1cc(O)ncn1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.39
CHKA P35790 1/20 0.39

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
SCHEMBL2627819 0.84 SMN1; SMN2 (0.33) CA2CHKA
SCHEMBL18590 0.84 CA2 (0.56) CA2CHKA
SCHEMBL602858 0.80 CA2 (0.38) CA2CHKA
Benzene SCHEMBL27848615 0.80 CA2 (0.52) CA2CHKA
SCHEMBL8175868 0.80 CA2 (0.38) CA2CHKA
Cyclopropane SCHEMBL27848616 0.78 CA2 (0.50) CA2CHKA
SCHEMBL601141 0.77 CA2 (0.35) CA2CHKA
SCHEMBL17816269 0.76 CA2 (0.41) CA2CHKA
SCHEMBL17586506 0.74 CA2 (0.40) CA2CHKA
SCHEMBL17816462 0.74 CA2 (0.40) CA2CHKA

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-2000063176-A2 DISUBSTITUTED PYRIDINES AND PYRIMIDINES AS HERBICIDES AND FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-10-26 WO disclosed