SCHEMBL22564059

SCHEMBL22564059

CCc1cccc(CC)c1COc1ccn(S)n1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.35
HTR1A P08908 1/20 0.35
PKM P14618 1/20 0.33
GABRA1 P14867 2/20 0.32
GABRB2 P47870 2/20 0.32
NR1H4 Q96RI1 1/20 0.30
ANPEP P15144 1/20 0.30
DPP4 P27487 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
SCHEMBL22564096 0.93 HTR1A (0.31) TAAR1HTR1APKM
SCHEMBL22564067 0.93 ELANE (0.32) TAAR1HTR1APKM
SCHEMBL22564250 0.92 CYP3A4 (0.37) TAAR1HTR1APKM
SCHEMBL22563935 0.90 HTR1A (0.31) TAAR1HTR1APKM
SCHEMBL22563874 0.90 SMN1; SMN2 (0.36) PKMNR1H4
SCHEMBL22564028 0.90 GABRA1 (0.34) TAAR1HTR1APKMGABRA1GABRB2
SCHEMBL22564500 0.90 PTGER1 (0.33) TAAR1HTR1APKM
SCHEMBL22564103 0.89 L3MBTL1 (0.39) TAAR1HTR1A
SCHEMBL22564015 0.89 L3MBTL1 (0.33) TAAR1HTR1A
SCHEMBL22564324 0.88 GABRA1 (0.33) TAAR1HTR1AGABRA1NR1H4

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