SCHEMBL5762282

SCHEMBL5762282

C[C@H]1OCC(=O)[C@H]1NC(=O)[C@H](CC1CC1)NC(=O)c1cc2ccccc2o1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 11/20 0.54
CTSL P07711 10/20 0.48
CTSB P07858 3/20 0.48
CTSS P25774 6/20 0.47
TAS1R3 Q7RTX0 3/20 0.46
TAS1R1 Q7RTX1 3/20 0.46
CTSV O60911 2/20 0.45
POLB P06746 1/20 0.45
RAB9A P51151 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
THRB P10828 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
SCHEMBL5744609 0.88 CTSK (0.70) CTSKCTSLCTSBCTSSTAS1R3
SCHEMBL5743549 0.86 CTSK (0.60) CTSKCTSLCTSBCTSSTAS1R3
SCHEMBL6485384 0.76 CTSL (0.47) CTSKCTSLCTSSCTSVNPC1
SCHEMBL5744937 0.76 TAS1R3 (0.64) CTSKCTSLCTSBTAS1R3TAS1R1
SCHEMBL5744346 0.74 TAS1R3 (0.50) CTSKCTSLCTSSTAS1R3TAS1R1
SCHEMBL13784229 0.74 CTSK (0.55) CTSKCTSLCTSBCTSSCTSV
SCHEMBL18851814 0.73 RAB9A (0.62) CTSKTAS1R3TAS1R1POLBRAB9A
SCHEMBL6697672 0.73 POLB (0.47) CTSKPOLBRAB9AMEN1NPC1
SCHEMBL5526540 0.73 CTSL (0.68) CTSKCTSLCTSBCTSSTAS1R3
SCHEMBL5626241 0.72 CTSS (0.39) CTSKCTSLCTSBCTSSCTSV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358183-B1 CYSTEINE PROTEASE INHIBITORS MEDIVIR AB (SE) 2006-04-12 EP disclosed
US-20050070598-A1 Cysteine protease inhibitors MEDIVIR AB (SE) 2005-03-31 US disclosed
US-20040229915-A1 Cysteine protease inhibitors MEDIVIR AB (SE) 2004-11-18 US disclosed
US-20030186962-A1 Cysteine protease inhibitors MEDIVIR AB (SE) 2003-10-02 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 (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-20030186962-A1 Cysteine protease inhibitors C1R, CTSS, CTSZ CTSK 4/4885CTSL 10/4885CTSB 12/4885
US-20050070598-A1 Cysteine protease inhibitors CTRL, CTSZ, CTSS CTSK 5/4885CTSL 13/4885CTSB 12/4885
US-20040229915-A1 Cysteine protease inhibitors C1R, CTRL, CTSK CTSK 3/4885CTSL 9/4885CTSB 10/4885

“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.