SCHEMBL4817499

SCHEMBL4817499

Cc1onc(-c2ccccc2)c1C(=O)N1[CH]CC(C)(C)C1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
HTT P42858 2/20 0.58
TSHR P16473 5/20 0.57
USP2 O75604 1/20 0.57
GAA P10253 2/20 0.56
MEN1 O00255 1/20 0.56
LMNA P02545 4/20 0.55
ALDH1A1 P00352 4/20 0.55
NPSR1 Q6W5P4 2/20 0.54
MAPT P10636 1/20 0.51
HPGD P15428 1/20 0.51
HSD17B10 Q99714 1/20 0.51
NPC1 O15118 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL6406984 0.81 KMT2A (0.59) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL4817495 0.80 LMNA (0.71) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL4817503 0.80 LMNA (0.71) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL13416928 0.75 KMT2A (0.68) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL3553134 0.75 SMN1; SMN2 (0.97) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL3539489 0.75 KMT2A (1.00) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL903110 0.73 KMT2A (1.00) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL316093 0.73 KMT2A (0.76) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL27722453 0.73 KMT2A (0.76) KMT2ASMN1; SMN2HTTTSHRUSP2
SCHEMBL3553965 0.73 TSHR (1.00) KMT2ASMN1; SMN2HTTTSHRUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7402606-B2 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin K inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION (US) 2008-07-22 US claimed
EP-1494663-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SmithKline Beecham Corporation (US) 2005-01-12 EP claimed
WO-2003086385-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-23 WO claimed
US-7402606-B2 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin K inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION (US) 2008-07-22 US disclosed
US-20050245596-A1 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin k inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION 2005-11-03 US disclosed
EP-1494663-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SmithKline Beecham Corporation (US) 2005-01-12 EP disclosed
WO-2003086385-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-23 WO 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-20050245596-A1 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin k inhibitors for the treatment of bone loss CTSK, CTSB, CTSD KMT2A 964/4885SMN1; SMN2 4728/4885HTT 4337/4885

“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.