SCHEMBL1623869

SCHEMBL1623869

OC[C@@H]1CCC(F)(F)C[C@@H]1COCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
SCN9A Q15858 1/20 0.36
TACR1 P25103 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSK P43235 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
HRH4 Q9H3N8 3/20 0.34
HRH3 Q9Y5N1 3/20 0.34
GBA1 P04062 2/20 0.34
UGCG Q16739 2/20 0.34
GBA2 Q9HCG7 2/20 0.34
EPHX2 P34913 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL1623867 1.00 LMNA (0.37) LMNATSHRBCHEACHESCN9A
SCHEMBL1624002 0.84 LMNA (0.37) LMNATSHRSCN9ATACR1CTSL
SCHEMBL1624004 0.84 LMNA (0.37) LMNATSHRSCN9ATACR1CTSL
SCHEMBL1625947 0.82 LMNA (0.39) LMNATSHRTACR1CTSLCTSB
SCHEMBL18279743 0.82 FFAR4 (0.43) LMNASCN9AFFAR4EPHX2
SCHEMBL17008624 0.82 FFAR4 (0.43) LMNASCN9AFFAR4EPHX2
SCHEMBL1625944 0.82 LMNA (0.39) LMNATSHRTACR1CTSLCTSB
SCHEMBL5117022 0.80 LMNA (0.36) LMNATSHRBCHEACHESCN9A
SCHEMBL1624359 0.80 LMNA (0.36) LMNATSHRBCHEACHESCN9A
SCHEMBL5026595 0.80 LMNA (0.36) LMNATSHRBCHEACHESCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928091-B2 Cathepsin cysteine protease inhibitors MERCK FROSST CANADA LTD. (CA) 2011-04-19 US disclosed
US-20090093444-A1 Cathepsin Cysteine Protease Inhibitors MERCK FROSST CANADA LTD. (CA) 2009-04-09 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-20090093444-A1 Cathepsin Cysteine Protease Inhibitors CTSB, CTSS, CTSZ LMNA 2431/4885TSHR 3675/4885BCHE 493/4885

“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.