SCHEMBL10822415

SCHEMBL10822415

COC(=O)c1ccc(CC(C)N(C(O)Cc2ccccc2)C(O)Cc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.49
▸ CA2 P00918 2/20 0.49
▸ TSHR P16473 1/20 0.47
▸ RAB9A P51151 4/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ LOXL2 Q9Y4K0 1/20 0.45
▸ MGLL Q99685 1/20 0.45
▸ MAPT P10636 3/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43
▸ HTT P42858 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ CYP4A11 Q02928 1/20 0.42
▸ SLC7A5 Q01650 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL10822413 1.00 CA1 (0.49) CA1CA2TSHRRAB9ANPC1
SCHEMBL9812035 0.78 GAA (0.55) TSHRRAB9AMAPTGAAKMT2A
SCHEMBL9811881 0.78 GAA (0.55) TSHRRAB9AMAPTGAAKMT2A
SCHEMBL9812040 0.78 CA1 (0.51) CA1CA2TSHRRAB9ANPC1
Hydrochloric Acid SCHEMBL9812039 0.78 GAA (0.54) TSHRRAB9AMAPTGAAKMT2A
SCHEMBL10808764 0.77 ADRB1 (0.49) CA1CA2TSHRLOXL2L3MBTL1
SCHEMBL1428309 0.77 CA1 (0.56) CA1CA2TSHRRAB9ANPC1
Toluene SCHEMBL10507285 0.76 TDP1 (0.54) CA1CA2TSHRRAB9ANPC1
Hydrochloric Acid SCHEMBL10508096 0.76 ADRB1 (0.48) CA1CA2TSHRLOXL2L3MBTL1
Hydrochloric Acid SCHEMBL10818347 0.76 ADRB1 (0.48) CA1CA2TSHRLOXL2L3MBTL1

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
US-4585796-A HYPOGLYCEMIC, ANTI-OBESITY HOFFMANN-LA ROCHE INC. (US) 1986-04-29 — — US disclosed
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