SCHEMBL22564028

SCHEMBL22564028

CCc1cccc(Br)c1COc1ccn(S)n1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
HTR1A P08908 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
PKM P14618 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
SCHEMBL22564059 0.90 TAAR1 (0.35) GABRA1GABRB2HTR1ATAAR1PKM
SCHEMBL22564231 0.90
SCHEMBL22564495 0.87
SCHEMBL22564321 0.87
SCHEMBL22564250 0.85 CYP3A4 (0.37) HTR1ATAAR1PKM
SCHEMBL22564500 0.84 PTGER1 (0.33) HTR1ATAAR1PKM
SCHEMBL22564067 0.84 ELANE (0.32) HTR1ATAAR1PKM
SCHEMBL22563935 0.84 HTR1A (0.31) HTR1ATAAR1PKM
SCHEMBL22564096 0.84 HTR1A (0.31) HTR1ATAAR1PKM
SCHEMBL18504298 0.84 GABRA1 (0.34) GABRA1GABRB2HTR1ATAAR1PKM

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-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed