SCHEMBL8302486

SCHEMBL8302486

Cn1ncc(Cl)c1-n1nn[nH]c1=O

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 2/20 0.33
KAT2B Q92831 2/20 0.33
BRD9 Q9H8M2 1/20 0.33
PRMT5 O14744 6/20 0.32
WDR77 Q9BQA1 6/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
PAX8 Q06710 1/20 0.31
CYP1A2 P05177 1/20 0.30
POLB P06746 1/20 0.30
CYP3A4 P08684 1/20 0.30
HTT P42858 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
SCHEMBL8303651 0.82 CYP1A2 (0.33) PRMT5WDR77ALDH1A1CYP1A2POLB
SCHEMBL8306660 0.77 PRMT5 (0.34) BPTFKAT2BBRD9PRMT5WDR77
SCHEMBL8688847 0.73 ADRB2 (0.38) CYP3A4
SCHEMBL8307507 0.72 PRMT5 (0.33) PRMT5WDR77ALDH1A1CYP1A2POLB
SCHEMBL8304232 0.71 KDM4E (0.37) ALDH1A1RAB9A
SCHEMBL8600146 0.69 HCAR1 (0.37)
SCHEMBL8306156 0.69
SCHEMBL8302516 0.69 PRMT5 (0.36) PRMT5WDR77ALDH1A1HPGDHTT
SCHEMBL8309135 0.68 CYP2C9 (0.37)
SCHEMBL8302418 0.68 KDM4E (0.33) NPC1RAB9ACYP1A2

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