SCHEMBL8550997

SCHEMBL8550997

CCC(C(C)=O)n1nnn(C(=O)N(c2ccc(F)cc2)C(C)C)c1=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MC4R P32245 3/20 0.33
MC1R Q01726 3/20 0.33
CCKAR P32238 1/20 0.32
CCKBR P32239 1/20 0.32
S100A4 P26447 1/20 0.31
GRIA2 P42262 3/20 0.31
GRIN1 Q05586 3/20 0.31
GRIN2A Q12879 3/20 0.31
CYP3A4 P08684 1/20 0.30
KMT2A Q03164 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
SCHEMBL8546021 0.90 MC4R (0.33) MC4RMC1RCCKARCCKBR
SCHEMBL8551711 0.88 ALDH1A1 (0.41) CCKARCCKBRKMT2A
SCHEMBL8552004 0.86 S100A4 (0.33) MC4RMC1RCCKARCCKBRS100A4
SCHEMBL8551420 0.83 MC4R (0.33) MC4RMC1RCCKARCCKBRGRIA2
SCHEMBL8550553 0.78 ALDH1A1 (0.40) CCKARCCKBRKMT2A
SCHEMBL8546092 0.78 MC4R (0.34) MC4RMC1RCCKARCCKBRS100A4
SCHEMBL8551811 0.76 MC4R (0.33) MC4RMC1RCCKARCCKBRGRIA2
SCHEMBL8551886 0.74 MC4R (0.32) MC4RMC1RCCKARCCKBRS100A4
SCHEMBL8550707 0.73 ALDH1A1 (0.41) KMT2A
SCHEMBL8547220 0.73 MC4R (0.35) MC4RMC1RCCKARCCKBRKMT2A

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-0820994-A1 Tetrazolinones as herbicides and intermediates NIHON BAYER AGROCHEM K.K. (JP) 1998-01-28 EP disclosed