SCHEMBL2292391

SCHEMBL2292391

CC[C@H](Cc1ccccc1)OC(C)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.56
CTSL P07711 2/20 0.56
CTSB P07858 2/20 0.56
SLC18A3 Q16572 1/20 0.49
ALDH1A1 P00352 1/20 0.47
ALPI P09923 1/20 0.47
PKM P14618 1/20 0.47
PTGS1 P23219 1/20 0.47
XIAP P98170 1/20 0.47
SLC7A5 Q01650 1/20 0.47
MMP12 P39900 1/20 0.47
CYP1A2 P05177 1/20 0.46
TRPA1 O75762 1/20 0.44
TSHR P16473 1/20 0.43
SRR Q9GZT4 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
MMP8 P22894 1/20 0.43

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
SCHEMBL3008826 1.00 CTSK (0.56) CTSKCTSLCTSBSLC18A3ALDH1A1
SCHEMBL1837096 0.87 CTSK (0.57) CTSKCTSLCTSBALPIPKM
SCHEMBL2289952 0.86 CTSK (0.56) CTSKCTSLCTSBALDH1A1ALPI
SCHEMBL12378816 0.86 CTSK (0.56) CTSKCTSLCTSBALDH1A1ALPI
SCHEMBL8921434 0.84 ALDH1A1 (0.46) CTSKCTSLCTSBALDH1A1ALPI
SCHEMBL21976912 0.84 CTSK (0.55) CTSKCTSLCTSBALPIPKM
SCHEMBL28665539 0.84 CTSL (0.42) CTSKCTSLCTSBSLC18A3ALDH1A1
SCHEMBL9280171 0.84 CTSK (0.55) CTSKCTSLCTSBALPIPKM
SCHEMBL28199415 0.83 CTSK (0.51) CTSKCTSLCTSBALDH1A1ALPI
SCHEMBL8811765 0.83 MMP12 (0.48) CTSKCTSLCTSBALDH1A1ALPI

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-8304223-B2 Isoforms of pig liver esterase ENZYMICALS AG (DE) 2012-11-06 US disclosed
US-20110207186-A1 Isoforms of Pig Liver Esterase ENZYMICALS AG (DE) 2011-08-25 US disclosed
US-7229817-B2 Recombinant porcine liver esterases, their use and a method for the production thereof DEGUSSA AG (DE) 2007-06-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110207186-A1 Isoforms of Pig Liver Esterase CES1, PIGO, PIGS CTSK 1846/4885CTSL 1341/4885CTSB 1339/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.