SCHEMBL18504754

SCHEMBL18504754

O=C(NO)c1cccc(SC(F)(F)F)c1COc1ccn(O)n1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HDAC11 Q96DB2 3/20 0.32
FFAR1 O14842 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
KDM4E B2RXH2 1/20 0.30
PDE5A O76074 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
SCHEMBL18504863 0.92 RXFP1 (0.33) FFAR4FFAR1RXFP1
SCHEMBL18504643 0.91 FFAR4 (0.32) FFAR4FFAR1RXFP1
SCHEMBL22564400 0.89 FFAR4 (0.32) FFAR4LMNAGAAHDAC11FFAR1
SCHEMBL18504920 0.88 FFAR4 (0.37) FFAR4FFAR1
SCHEMBL18500400 0.88 POLB (0.37) FFAR4LMNAKDM4E
SCHEMBL18504396 0.87 FFAR4 (0.34) FFAR4FFAR1
SCHEMBL18505002 0.87 FFAR4 (0.34) FFAR4FFAR1
SCHEMBL18504566 0.87 FFAR4 (0.34) FFAR4FFAR1KDM4E
SCHEMBL18504765 0.86 PDE5A (0.31) PDE5A
SCHEMBL18504862 0.86 TSHR (0.34) LMNAGAAPDE5A

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
US-9565856-B2 Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-14 US disclosed