SCHEMBL22563906

SCHEMBL22563906

CCCc1cccc(C(=O)Cl)c1COc1ccn(S)n1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.32
HCRTR1 O43613 2/20 0.32
HCRTR2 O43614 2/20 0.32
NR1H4 Q96RI1 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31

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
SCHEMBL20845053 0.92 NR1H4 (0.33) NR1H4
SCHEMBL22564276 0.90 FOLH1 (0.35) LTB4RLTB4R2NR1H4
SCHEMBL22564312 0.89 LTB4R (0.32) LTB4RLTB4R2HCRTR1HCRTR2NR1H4
SCHEMBL22564290 0.89 MEN1 (0.34) LTB4RLTB4R2HCRTR1HCRTR2
SCHEMBL18504352 0.89 LTB4R (0.33) LTB4RLTB4R2HCRTR1HCRTR2NR1H4
SCHEMBL22564142 0.88 ADORA3 (0.31) LTB4RLTB4R2HCRTR1HCRTR2NR1H4
SCHEMBL22564198 0.88 ALDH1A1 (0.36) HCRTR1HCRTR2
SCHEMBL22564298 0.87 TSHR (0.39)
SCHEMBL22564152 0.87 HCRTR1 (0.31) LTB4RLTB4R2HCRTR1HCRTR2NR1H4
SCHEMBL22564537 0.87 PDE5A (0.32) LTB4RLTB4R2HCRTR1HCRTR2

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