SCHEMBL15765652

SCHEMBL15765652

CC(C)C[C@H](NC(=O)c1cc2cc(OCCN3CCOCC3)ccc2o1)C(=O)N[C@H]1CCCN(C(=O)Cc2cccc(-c3ccccn3)c2)CC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 19/20 1.00
CTSL P07711 16/20 1.00
CTSS P25774 12/20 1.00
CTSB P07858 6/20 1.00
CTSV O60911 2/20 0.52

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
SCHEMBL4690508 0.86 CTSK (0.74) CTSKCTSLCTSSCTSBCTSV
SCHEMBL4765813 0.85 CTSK (0.73) CTSKCTSLCTSSCTSBCTSV
SCHEMBL4689513 0.81 CTSK (0.67) CTSKCTSLCTSSCTSBCTSV
SCHEMBL14345772 0.79 CTSK (0.64) CTSKCTSLCTSSCTSBCTSV
SCHEMBL4764918 0.79 CTSK (0.64) CTSKCTSLCTSSCTSBCTSV
SCHEMBL3046987 0.79 CTSK (0.64) CTSKCTSLCTSSCTSBCTSV
SCHEMBL20915172 0.79 CTSK (0.64) CTSKCTSLCTSSCTSBCTSV
SCHEMBL5141688 0.78 CTSK (0.75) CTSKCTSLCTSSCTSBCTSV
SCHEMBL7571991 0.76 CTSK (0.64) CTSKCTSLCTSSCTSBCTSV
SCHEMBL4861708 0.76 CTSK (0.71) CTSKCTSLCTSSCTSBCTSV

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-9943522-B2 Use of cathepsin K inhibition for the treatment and/or prophylaxis of pulmonary hypertension and/or heart failure BAYER INTELLECTUAL PROPERTY GMBH (DE) 2018-04-17 US disclosed
US-20140155383-A1 USE OF CATHEPSIN K INHIBITION FOR THE TREATMENT AND/OR PROPHYLAXIS OF PULMONARY HYPERTENSION AND/OR HEART FAILURE BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-06-05 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-20140155383-A1 USE OF CATHEPSIN K INHIBITION FOR THE TREATMENT AND/OR PROPHYLAXIS OF PULMONARY HYPERTENSION AND/OR HEART FAILURE CTSK, CTSF, CTSS CTSK 1/4885CTSL 6/4885CTSS 3/4885

“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.