SCHEMBL8842403

SCHEMBL8842403

CCC1CCC(n2nn[nH]c2=O)CC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL5906119 0.86
SCHEMBL8601462 0.78 ALDH1A1 (0.36)
SCHEMBL8041048 0.74 NFE2L2 (0.30)
SCHEMBL8843329 0.69 JAK2 (0.38)
SCHEMBL8842637 0.67 ALDH1A1 (0.38) HTT
SCHEMBL8041713 0.67
SCHEMBL7968344 0.66 ALDH1A1 (0.35) MEN1KMT2A
SCHEMBL8843336 0.66 HCAR1 (0.36) HTTMEN1KMT2A
SCHEMBL8036969 0.65 NFE2L2 (0.31)
SCHEMBL3172918 0.64

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5605920-A HERBICIDES, SELECTIVE IN PADDY FIELDS NIHON BAYER AGROCHEM K.K. (JP) 1997-02-25 US disclosed
EP-0733625-A1 1-Substituted-tetrazolinones and their use as herbicides NIHON BAYER AGROCHEM K.K. (JP) 1996-09-25 EP disclosed