SCHEMBL7974908

SCHEMBL7974908

O=C(c1cncc(Cl)c1)C(F)(F)F

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.60
SMYD3 Q9H7B4 1/20 0.42
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
CES1 P23141 1/20 0.41
PKM P14618 1/20 0.39
ACHE P22303 2/20 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
SCHEMBL3665638 0.78 HCAR2 (0.67) HCAR2SMYD3MKNK1MKNK2PKM
SCHEMBL27417421 0.78 HCAR2 (0.67) HCAR2SMYD3MKNK1MKNK2PKM
SCHEMBL44147 0.77 TPMT (0.52) CES1ACHE
SCHEMBL23181527 0.77 HCAR2 (0.41) HCAR2CES1ACHE
SCHEMBL16600044 0.77 POLB (0.60) HCAR2SMYD3
SCHEMBL3473330 0.77 HCAR2 (0.60) HCAR2SMYD3CES1ACHE
SCHEMBL24198754 0.77 HCAR2 (0.55) HCAR2SMYD3MKNK1MKNK2PKM
SCHEMBL486309 0.75 HCAR2 (1.00) HCAR2SMYD3MKNK1MKNK2
SCHEMBL4196968 0.75 HCAR2 (0.69) HCAR2SMYD3MKNK1MKNK2PKM
SCHEMBL29944817 0.75 HCAR2 (1.00) HCAR2SMYD3MKNK1MKNK2

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-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO disclosed