SCHEMBL6151247

SCHEMBL6151247

C/C=C(/C(=O)O)c1ccccc1COc1cc(Cl)c(OCc2ccccc2)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.44
ALDH1A1 P00352 1/20 0.43
S1PR1 P21453 1/20 0.43
PRKX P51817 1/20 0.43
ACVR1 Q04771 1/20 0.43
S1PR5 Q9H228 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.41
LMNA P02545 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
MAOB P27338 2/20 0.41
NR4A2 P43354 2/20 0.39
CAPN1 P07384 1/20 0.39

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
SCHEMBL5077102 0.95 HIF1A (0.48) HIF1AALDH1A1S1PR1PRKXACVR1
SCHEMBL6151249 0.90 HIF1A (0.44) HIF1AALDH1A1S1PR1PRKXACVR1
SCHEMBL6151245 0.90 HIF1A (0.44) HIF1AALDH1A1S1PR1PRKXACVR1
SCHEMBL5075977 0.90 RAB9A (0.48) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL5079483 0.88 MRGPRX4 (0.46) HIF1AALDH1A1MEN1KMT2ANPC1
SCHEMBL5075922 0.88 FABP3 (0.52) ALDH1A1S1PR1S1PR5MEN1KMT2A
SCHEMBL5080507 0.88 TP53 (0.41) HIF1AALDH1A1MEN1KMT2ANPC1
SCHEMBL5074492 0.87 TP53 (0.40) HIF1AALDH1A1MEN1KMT2ANPC1
SCHEMBL5076979 0.87 TP53 (0.40) HIF1AALDH1A1MEN1KMT2ANPC1
SCHEMBL5080373 0.87 HTT (0.40) HIF1AALDH1A1MEN1KMT2ANPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1494991-A1 ANALOGOUS COMPOUNDS OF STROBILURINES AND THEIR USE AS ACARICIDES AND INSECTICIDES Isagro Ricerca S.r.l. (IT) 2005-01-12 EP disclosed
WO-2003087032-A1 ANALOGOUS COMPOUNDS OF STROBILURINES AND THEIR USE AS ACARICIDES AND INSECTICIDES ISAGRO RICERCA S.R.L. (IT) 2003-10-23 WO disclosed