SCHEMBL8302418

SCHEMBL8302418

Cn1cc(Cl)c(-n2nn[nH]c2=O)n1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 2/20 0.33
RXFP1 Q9HBX9 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
TSHR P16473 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
SCHEMBL8308632 0.82
SCHEMBL8307265 0.77 ADORA2A (0.32)
SCHEMBL8303900 0.72 MAPT (0.36) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL8302489 0.72 NFE2L2 (0.32) NPC1RAB9A
SCHEMBL8603507 0.68 RPS6KA5 (0.35)
SCHEMBL8687317 0.68 HSD11B1 (0.35) CYP1A2
SCHEMBL8689003 0.68 MEN1 (0.38) KDM4ESMN1; SMN2LMNATSHR
SCHEMBL8302486 0.68 BPTF (0.33) NPC1RAB9ACYP1A2
SCHEMBL8307793 0.67
SCHEMBL8305449 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 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