SCHEMBL27888125

SCHEMBL27888125

O=C(O)COC(=O)[C@H](CO)NC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 5/20 0.51
▸ CA2 P00918 2/20 0.46
▸ CA1 P00915 1/20 0.46
▸ ACE P12821 1/20 0.45
▸ GPR139 Q6DWJ6 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ CTSS P25774 2/20 0.42
▸ CTSK P43235 2/20 0.42
▸ CTSB P07858 1/20 0.42
▸ CASP1 P29466 1/20 0.41
▸ GAA P10253 2/20 0.41
▸ PDE4A P27815 1/20 0.41
▸ RAB9A P51151 1/20 0.41

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
SCHEMBL20838261 0.85 CTSL (0.71) CTSLCA2CA1ACELMNA
SCHEMBL19437162 0.85 CTSL (0.71) CTSLCA2CA1ACELMNA
SCHEMBL26199837 0.84 CYP26A1 (0.53) CTSLGPR139TDP1GAARAB9A
SCHEMBL27673425 0.84 CYP26A1 (0.53) CTSLGPR139TDP1GAARAB9A
SCHEMBL10024019 0.84 GAA (0.56) CTSLCA2CA1GPR139LMNA
SCHEMBL5672076 0.84 GAA (0.56) CTSLCA2CA1GPR139LMNA
SCHEMBL8656506 0.83 ACE (0.63) CTSLACETDP1CTSSCTSK
SCHEMBL12729964 0.83 ACE (0.63) CTSLACETDP1CTSSCTSK
SCHEMBL2791574 0.80 CA2 (0.66) CA2CA1ACE
SCHEMBL2792747 0.80 CA2 (0.66) CA2CA1ACE

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
CN-102711720-A Pigmentation preventing or improving agent POLA CHEM IND INC 2012-10-03 — — CN disclosed
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