SCHEMBL3579176

SCHEMBL3579176

CC(CCc1ccc(Cl)c(C=O)c1)NC(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 2/20 0.41
CTSK P43235 3/20 0.39
CTSS P25774 1/20 0.39
CA2 P00918 4/20 0.39
AAK1 Q2M2I8 1/20 0.39
PPARA Q07869 3/20 0.38
PPARG P37231 2/20 0.38
KCNH2 Q12809 2/20 0.37
TMEM97 Q5BJF2 2/20 0.37
ACACB O00763 1/20 0.37
ATM Q13315 1/20 0.37
CA1 P00915 1/20 0.37
CA7 P43166 1/20 0.37
EPHX2 P34913 1/20 0.37
CTSL P07711 1/20 0.36

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
SCHEMBL995999 0.87 LIPG (0.45) LIPGCTSKCTSSCA2AAK1
SCHEMBL29952190 0.79 TSHR (0.54) CA2CA1
SCHEMBL3087044 0.76 CDK8 (0.41) KCNH2
SCHEMBL26508733 0.76 CYP17A1 (0.56) PPARAPPARGCA1
SCHEMBL10981741 0.76 CTSK (0.62) CTSKCTSSATM
SCHEMBL28733236 0.76 CTSK (0.62) CTSKCTSSATM
SCHEMBL10974978 0.76 CTSK (0.62) CTSKCTSSATM
SCHEMBL27741108 0.76 CTSK (0.47) CTSKCTSSCA2ATM
SCHEMBL1743893 0.75 CTSK (0.43) CTSKCTSSCA2ATMCA1
SCHEMBL3081036 0.74 TSHR (0.36)

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-20100324052-A1 NOVEL PIPERIDINE CARBOXYLIC ACID AMINE DERIVATIVES BEZENCON OLIVIER 2010-12-23 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-20100324052-A1 NOVEL PIPERIDINE CARBOXYLIC ACID AMINE DERIVATIVES REN, ACE, AGTR2 LIPG 582/4885CTSK 163/4885CTSS 144/4885

“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.