SCHEMBL8304918

SCHEMBL8304918

Cc1cc(-n2nn[nH]c2=O)c(C)s1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 1/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL8303401 0.73 KDM4E (0.31) PLA2G10ALDH1A1
SCHEMBL8304805 0.71
SCHEMBL8686501 0.71 TLR8 (0.32)
SCHEMBL8303549 0.70
SCHEMBL9730122 0.70 GRIN2D (0.41)
SCHEMBL8977342 0.70 NPSR1 (0.45) ALDH1A1
SCHEMBL8302526 0.70 NQO1 (0.32)
SCHEMBL5906376 0.69 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL8309718 0.69
SCHEMBL8599564 0.68 HSP90AA1 (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0695748-B1 Tetrazolinone herbicides BAYER AGROCHEM KK (JP) 1999-05-06 EP disclosed
US-5589439-A HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 1996-12-31 US disclosed
EP-0695748-A1 Tetrazolinone herbicides NIHON BAYER AGROCHEM K.K. (JP) 1996-02-07 EP disclosed