SCHEMBL14878751

SCHEMBL14878751

CC(F)c1ccc(C(C)(F)F)nc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.35
NR1I2 O75469 1/20 0.33
CYP2C9 P11712 1/20 0.33
MLYCD O95822 2/20 0.33
PDE2A O00408 1/20 0.32
PDE4A P27815 1/20 0.31
KCNH2 Q12809 1/20 0.31
HDAC6 Q9UBN7 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
SCHEMBL17775982 0.86 TRPV4 (0.36) TRPV4NR1I2CYP2C9MLYCDPDE2A
SCHEMBL14451426 0.83 PTPN5 (0.36) TRPV4NR1I2CYP2C9MLYCDPDE2A
SCHEMBL30521437 0.83 PTPN5 (0.36) TRPV4NR1I2CYP2C9MLYCDPDE2A
SCHEMBL21377045 0.83 TRPV4 (0.38) TRPV4NR1I2CYP2C9MLYCDPDE2A
SCHEMBL13262415 0.79 TRPV4 (0.32) TRPV4NR1I2CYP2C9MLYCD
SCHEMBL17775927 0.74 TRPV4 (0.36) TRPV4NR1I2CYP2C9MLYCDPDE2A
SCHEMBL19619488 0.73 TRPV4 (0.39) TRPV4NR1I2CYP2C9MLYCDPDE2A
SCHEMBL15603407 0.73 TRPV4 (0.48) TRPV4NR1I2CYP2C9PDE2A
SCHEMBL27841661 0.73 TRPV4 (0.48) TRPV4NR1I2CYP2C9PDE2A
SCHEMBL16116586 0.73 GPR55 (0.32) NR1I2CYP2C9KCNH2HDAC6

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-2351740-B1 Insecticidal composition comprising N-substituted (6-haloalkylpyridin-3-yl)alkyl sulfoximines DOW AGROSCIENCES LLC (US) 2013-04-24 EP disclosed