SCHEMBL10477162

SCHEMBL10477162

COc1cccc(N(C=O)[Si](C)(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.51
MTNR1A P48039 6/20 0.41
MTNR1B P49286 6/20 0.41
HSD17B2 P37059 2/20 0.41
HSD17B1 P14061 1/20 0.41
ACHE P22303 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
ESR1 P03372 1/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
ADRA2A P08913 1/20 0.39
ADRA1A P35348 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
SCHEMBL28255210 0.77 ALOX15 (0.55) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL27522069 0.76 ALOX15 (0.54) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL31256052 0.72 ACHE (0.54) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL20979821 0.72 ACHE (0.54) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL1134082 0.70 MTNR1A (0.61) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL30054343 0.70 MTNR1A (0.61) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL29636366 0.70 ACHE (0.52) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL820669 0.70 ACHE (0.52) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1
SCHEMBL9641463 0.70 OXTR (0.42) HSD17B2HSD17B1CA1CA2ALDH1A1
SCHEMBL12837169 0.70 MTNR1A (0.54) ALOX15MTNR1AMTNR1BHSD17B2HSD17B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4880831-A META SUBSTITUTED ETHERS STAUFFER CHEMICAL COMPANY (US) 1989-11-14 US disclosed
US-4797416-A APPLYING TO PLANTS STAUFFER CHEMICAL CO. (US) 1989-01-10 US disclosed
EP-0274271-A1 Fungicidal carbanilates, process for the production thereof, compositions containing them and method of use thereof STAUFFER AGRICULTURAL CHEMICALS COMPANY, INC. (US) 1988-07-13 EP disclosed