SCHEMBL8551872

SCHEMBL8551872

O=C1CCCCC1n1nn[nH]c1=O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 4/20 0.38
HCAR1 Q9BXC0 2/20 0.38
SLC18A3 Q16572 1/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
KMT2A Q03164 1/20 0.33

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
SCHEMBL8550727 0.95 SRC (0.35) SRCHCAR1SLC18A3
SCHEMBL8550105 0.76 CHRM2 (0.31)
SCHEMBL8601462 0.76 ALDH1A1 (0.36) HCAR1
SCHEMBL5906267 0.74 ALDH1A1 (0.39) HCAR1KMT2A
SCHEMBL8547578 0.73 CHRM3 (0.35)
SCHEMBL8054882 0.71
SCHEMBL8843336 0.70 HCAR1 (0.36) HCAR1KMT2A
SCHEMBL8546057 0.68 CHRM3 (0.36)
SCHEMBL8054914 0.67
SCHEMBL8843267 0.67

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