SCHEMBL7971834

SCHEMBL7971834

Clc1cccc([CH]c2cccc(Oc3ccccc3)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 1/20 0.42
TLR2 O60603 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
ALOX5 P09917 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
PTGS1 P23219 2/20 0.39
PTGS2 P35354 2/20 0.39
MAOB P27338 1/20 0.39
NFE2L2 Q16236 1/20 0.39
PPARG P37231 1/20 0.38
EPOR P19235 1/20 0.38
AKR1B1 P15121 1/20 0.38
GFER P55789 1/20 0.38
KMT2A Q03164 1/20 0.38
GPR18 Q14330 1/20 0.37
ALOX5AP P20292 1/20 0.36
MMP3 P08254 1/20 0.36

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
SCHEMBL7972007 0.83 NFE2L2 (0.54) NFE2L2KMT2A
SCHEMBL7969857 0.77 NFE2L2 (0.49) MAPTSMN1; SMN2MAOBNFE2L2KMT2A
SCHEMBL7970291 0.74 TP53 (0.44) LMNAMAPTALOX5SMN1; SMN2ALDH1A1
SCHEMBL7972130 0.72 ALOX5 (0.44) TLR4TLR2LMNAMAPTALOX5
SCHEMBL11230775 0.71 TLR4 (0.53) TLR4TLR2LMNAMAPTALOX5
SCHEMBL7958651 0.70 NFE2L2 (0.56) LMNAMAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL16608257 0.70 GRM4 (0.61) LMNAMAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL27900292 0.69 TLR4 (0.64) TLR4TLR2ALOX5PTGS1PTGS2
SCHEMBL4553033 0.69 TLR4 (0.54) TLR4TLR2LMNAMAPTALOX5
SCHEMBL4711271 0.69 GRM4 (0.69) TLR4TLR2LMNAMAPTALOX5

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
WO-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO disclosed