SCHEMBL3704293

SCHEMBL3704293

CC(C)(C)OC(=O)NC(Cc1ccc(-c2ccccc2)cc1)C(=O)NCCC#N

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSS P25774 18/20 0.84
CTSK P43235 16/20 0.84
CTSB P07858 4/20 0.74
CTSL P07711 2/20 0.74
AKT1 P31749 1/20 0.59

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
SCHEMBL3704295 1.00 CTSS (0.84) CTSSCTSKCTSBCTSLAKT1
SCHEMBL6790738 0.95 CTSS (0.83) CTSSCTSKCTSBCTSLAKT1
SCHEMBL6019878 0.95 CTSS (0.83) CTSSCTSKCTSBCTSLAKT1
SCHEMBL3696863 0.89 CTSL (0.68) CTSSCTSKCTSBCTSLAKT1
SCHEMBL3696864 0.89 CTSL (0.68) CTSSCTSKCTSBCTSLAKT1
SCHEMBL6021008 0.89 CTSS (0.81) CTSSCTSKCTSBCTSLAKT1
SCHEMBL6019886 0.87 CTSS (0.83) CTSSCTSKCTSBCTSL
SCHEMBL8739537 0.86 CTSS (0.74) CTSSCTSKCTSBCTSLAKT1
SCHEMBL6020639 0.85 CTSS (1.00) CTSSCTSKCTSBCTSL
SCHEMBL14599153 0.85 CTSS (1.00) CTSSCTSKCTSBCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877815-B2 Substituted carbamoylcycloalkyl acetic acid derivatives as NEP NOVARTIS AG (CH) 2014-11-04 US disclosed
US-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP NOVARTIS AG (CH) 2012-05-17 US disclosed
EP-0660840-B1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES CIBA GEIGY AG (CH) 1997-05-07 EP disclosed
WO-1996026729-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES AS ECE INHIBITORS CIBA-GEIGY AG (CH) 1996-09-06 WO disclosed
US-5550119-A ENDOTHELIN-CONVERTING ENZYM INHIBITORS CIBA-GEIGY CORPORATION (US) 1996-08-27 US disclosed
EP-0660840-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES. CIBA GEIGY AG (CH) 1995-07-05 EP disclosed
WO-1994005677-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES CIBA-GEIGY AG (CH) 1994-03-17 WO disclosed
US-5273990-A 5-Phosphonomethyleneamino aryl-substitued alkylene-1H-tetazoles CIBA-GEIGY CORPORATION (US) 1993-12-28 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-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP MME, REN, ECE1 CTSS 357/4885CTSK 252/4885CTSB 234/4885

“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.