SCHEMBL31534045

SCHEMBL31534045

CCCC(=O)OC(Cc1ccccc1)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.53
CTSL P07711 3/20 0.53
CTSB P07858 3/20 0.53
CTSH P09668 3/20 0.53
ACE P12821 2/20 0.47
TSHR P16473 2/20 0.46
ALOX15 P16050 1/20 0.46
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TRPA1 O75762 2/20 0.42
CYP3A4 P08684 1/20 0.41
CYP1A2 P05177 1/20 0.41
CPA3 P15088 1/20 0.40
FOLH1 Q04609 1/20 0.40

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
SCHEMBL4223740 0.85 CTSK (0.50) CTSKCTSLCTSBCTSHACE
SCHEMBL10333475 0.85 CTSK (0.50) CTSKCTSLCTSBCTSHACE
SCHEMBL21850415 0.81 ACE (0.47) CTSKCTSLCTSBCTSHACE
SCHEMBL14765434 0.80 CTSL (0.51) CTSKCTSLCTSBCTSHTSHR
SCHEMBL25409831 0.79 CTSL (0.50) CTSKCTSLCTSBCTSHTSHR
SCHEMBL10654895 0.79 CTSL (0.53) CTSKCTSLCTSBCTSHTSHR
SCHEMBL29488549 0.78 CTSK (0.54) CTSKCTSLCTSBCTSHACE
SCHEMBL16670057 0.76 CTSK (0.48) CTSKCTSLCTSBCTSHACE
SCHEMBL15578483 0.76 CTSK (0.46) CTSKCTSLCTSBCTSHACE
SCHEMBL8916933 0.75 CTSK (0.47) CTSKCTSLCTSBCTSHACE

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-119584860-A Comprising biodegradable microcapsule composition 奇华顿股份有限公司 2025-03-07 CN disclosed