SCHEMBL15380893

SCHEMBL15380893

CN(C)CCCC(NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 11/20 0.49
CTSS P25774 4/20 0.49
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
JAK3 P52333 1/20 0.43
BTK Q06187 1/20 0.43
PPARA Q07869 2/20 0.42
PPARG P37231 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
SCHEMBL29398937 1.00 CTSK (0.49) CTSKCTSSMEN1GAAKMT2A
SCHEMBL12592642 1.00 CTSK (0.49) CTSKCTSSMEN1GAAKMT2A
SCHEMBL21571253 0.95 CTSK (0.48) CTSKCTSSMEN1GAAKMT2A
SCHEMBL1411658 0.95 CTSK (0.48) CTSKCTSSMEN1GAAKMT2A
SCHEMBL3004548 0.95 CTSK (0.48) CTSKCTSSMEN1GAAKMT2A
Trifluoroacetic Acid SCHEMBL17688441 0.94 CTSK (0.51) CTSKCTSSMEN1GAAKMT2A
SCHEMBL690295 0.91 CTSK (0.47) CTSKCTSSMEN1GAAKMT2A
SCHEMBL633418 0.91 CTSK (0.47) CTSKCTSSMEN1GAAKMT2A
SCHEMBL6837916 0.87 CTSK (0.56) CTSKCTSSMEN1GAAKMT2A
SCHEMBL6745774 0.87 CTSK (0.56) CTSKCTSSMEN1GAAKMT2A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11071771-B2 Butyrylcholinesterase zwitterionic polymer conjugates KODIAK SCIENCES INC. (US) 2021-07-27 US disclosed
US-20190255155-A1 BUTYRYLCHOLINESTERASE ZWITTERIONIC POLYMER CONJUGATES OLIGASIS, LLC 2019-08-22 US disclosed
US-10363290-B2 Butyrylcholinesterase zwitterionic polymer conjugates KODIAK SCIENCES INC. (US) 2019-07-30 US disclosed
CN-107208076-A Butyrylcholine esterase amphoteric ion polymer conjugate 科达制药 2017-09-26 CN disclosed
US-20160184445-A1 BUTYRYLCHOLINESTERASE ZWITTERIONIC POLYMER CONJUGATES OLIGASIS, LLC 2016-06-30 US disclosed
US-20160184445-A1 BUTYRYLCHOLINESTERASE ZWITTERIONIC POLYMER CONJUGATES OLIGASIS, LLC 2016-06-30 US disclosed
US-8846739-B2 TGR5 agonists EXELIXIS PATENT COMPANY LLC (US) 2014-09-30 US disclosed
US-20130303505-A1 TGR5 AGONISTS EXELIXIS PATENT COMPANY LLC 2013-11-14 US disclosed
CN-102781922-A TGR5 agonists EXELIXIS INC 2012-11-14 CN 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 (5 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-10363290-B2 Butyrylcholinesterase zwitterionic polymer conjugates BCHE, ACHE, FCER2 CTSK 1996/4885CTSS 1380/4885MEN1 3310/4885
US-20160184445-A1 BUTYRYLCHOLINESTERASE ZWITTERIONIC POLYMER CONJUGATES BCHE, ACHE, FCER2 CTSK 1996/4885CTSS 1380/4885MEN1 3310/4885
US-11071771-B2 Butyrylcholinesterase zwitterionic polymer conjugates BCHE, ACHE, FCER2 CTSK 1996/4885CTSS 1380/4885MEN1 3310/4885
US-20190255155-A1 BUTYRYLCHOLINESTERASE ZWITTERIONIC POLYMER CONJUGATES BCHE, ACHE, FCER2 CTSK 1996/4885CTSS 1380/4885MEN1 3310/4885
US-20130303505-A1 TGR5 AGONISTS GCGR, NPY5R, TBXA2R CTSK 3170/4885CTSS 3876/4885MEN1 4002/4885

“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.