SCHEMBL6851697

SCHEMBL6851697

N#CN1CCC(NC(=O)c2ccccc2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 4/20 1.00
▸ CTSK P43235 3/20 1.00
▸ CTSL P07711 3/20 1.00
▸ USP30 Q70CQ3 16/20 0.79
▸ CTSS P25774 2/20 0.76
▸ CTSC P53634 2/20 0.76

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
SCHEMBL21324958 0.96 CTSB (0.93) CTSBCTSKCTSLUSP30CTSS
Cyanamide SCHEMBL6859700 0.96 CTSB (0.92) CTSBCTSKCTSLUSP30CTSS
SCHEMBL7009469 0.92 CTSB (1.00) CTSBCTSKCTSLUSP30CTSS
SCHEMBL6858886 0.92 CTSB (1.00) CTSBCTSKCTSLUSP30CTSS
SCHEMBL23000673 0.89 USP30 (0.87) CTSBCTSKCTSLUSP30
SCHEMBL18115475 0.89 USP30 (1.00) CTSBCTSKCTSLUSP30CTSS
SCHEMBL22068296 0.88 CTSB (0.78) CTSBCTSKCTSLUSP30CTSS
SCHEMBL21324322 0.88 CTSB (0.77) CTSBCTSKCTSLUSP30CTSS
SCHEMBL19998580 0.86 CTSB (0.76) CTSBCTSKCTSLUSP30CTSS
SCHEMBL19998575 0.86 CTSB (0.76) CTSBCTSKCTSLUSP30CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6835727-B2 Bone disorders; osteoporosis; rheumatic diseases MERCK FROSST CANADA & CO. (CA) 2004-12-28 — — US claimed
US-20030229226-A1 Cathepsin cysteine protease inhibitors MERCK FROSST CANADA LTD. (CA) 2003-12-11 — — US claimed
EP-1272467-A4 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK FROSST CANADA INC (CA) 2003-05-07 — — EP claimed
EP-1272467-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK FROSST CANADA INC. (CA) 2003-01-08 — — EP claimed
WO-2001077073-A1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK FROSST CANADA & CO. (CA) 2001-10-18 — — WO claimed

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-20030229226-A1 Cathepsin cysteine protease inhibitors CTSK, CTSZ, CTSE CTSB 5/4885CTSK 1/4885CTSL 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.

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