SCHEMBL1189554

SCHEMBL1189554

COC(=O)C1(NC(=O)OCc2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.57
CTSL P07711 4/20 0.57
CTSB P07858 3/20 0.57
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
CTSK P43235 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 3/20 0.47
LMNA P02545 1/20 0.47
CYP3A4 P08684 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
PPIA P62937 1/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44

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
Hydrochloric Acid SCHEMBL29158039 0.99 CTSS (0.56) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL2746328 0.93 CTSS (0.52) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL5516561 0.91 CTSS (0.52) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL3334735 0.91 TLR2 (0.53) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL2913795 0.89 CTSS (0.55) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL19031260 0.87 CTSB (0.51) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL10581164 0.87 CTSS (0.51) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL14751533 0.87 CTSS (0.58) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL1811146 0.86 CTSS (0.54) CTSSCTSLCTSBNPC1RAB9A
SCHEMBL143763 0.86 CTSS (0.57) CTSSCTSLCTSBNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208992-A1 MACROCYCLES AS CFTR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2024-06-27 US disclosed
EP-4308575-A1 MACROCYCLES AS CFTR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2024-01-24 EP disclosed
CN-117062814-A Compounds that rapidly accelerate fibrosarcoma protein degradation and related methods of use 阿维纳斯运营公司 2023-11-14 CN disclosed
CN-116981672-A Macrocyclic compounds as CFTR modulators 爱杜西亚药品有限公司 2023-10-31 CN disclosed
WO-2022194399-A1 MACROCYCLES AS CFTR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2022-09-22 WO disclosed
EP-2217226-B1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2015-07-22 EP disclosed
US-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2013-02-21 US disclosed
US-7893056-B2 Peptide deformylase inhibitors GLAXOSMITHKLINE LLC (US) 2011-02-22 US disclosed
EP-2217226-A1 PEPTIDE DEFORMYLASE INHIBITORS GlaxoSmithKline LLC (US) 2010-08-18 EP disclosed
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2009-12-10 US disclosed
WO-2009061879-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-05-14 WO 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 (3 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-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DPEP1, DHPS CTSS 665/4885CTSL 397/4885CTSB 650/4885
US-20240208992-A1 MACROCYCLES AS CFTR MODULATORS CFTR, PKD1, ARRB1 CTSS 2999/4885CTSL 4121/4885CTSB 3816/4885
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DHPS, PADI3 CTSS 662/4885CTSL 445/4885CTSB 875/4885

“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.