SCHEMBL4819622

SCHEMBL4819622

CN(C)CCNC(=O)[C@@H]1CCCC[C@@H]1N

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
PKM P14618 1/20 0.43
CTSB P07858 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
HSD11B1 P28845 1/20 0.38
TAAR1 Q96RJ0 2/20 0.36
GRM4 Q14833 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
MERTK Q12866 1/20 0.35
CACNA1G O43497 4/20 0.35
CACNA1H O95180 4/20 0.35
CACNA1B Q00975 1/20 0.35

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
SCHEMBL30039105 1.00 L3MBTL1 (0.47) L3MBTL1PKMCTSBCTSSCTSK
SCHEMBL4819619 0.84 L3MBTL1 (0.47) L3MBTL1PKMCTSBCTSSCTSK
SCHEMBL24098175 0.82 L3MBTL1 (0.48) L3MBTL1PKMCTSBCTSSCTSK
SCHEMBL19849366 0.82 L3MBTL1 (0.48) L3MBTL1PKMCTSBCTSSCTSK
SCHEMBL20879973 0.82 L3MBTL1 (0.48) L3MBTL1PKMCTSBCTSSCTSK
SCHEMBL4824959 0.80 TAAR1 (0.40) TAAR1GRM4ALDH1A1POLBCACNA1G
SCHEMBL4598377 0.80 TAAR1 (0.40) TAAR1GRM4ALDH1A1POLBCACNA1G
SCHEMBL4598385 0.80 TAAR1 (0.40) TAAR1GRM4ALDH1A1POLBCACNA1G
SCHEMBL24334219 0.79 L3MBTL1 (0.46) L3MBTL1PKMCTSBCTSSCTSK
SCHEMBL11616910 0.79 NAAA (0.53) L3MBTL1POLB

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
US-7358373-B2 Cathepsin K inhibitors ROCHE PALO ALTO LLC (US) 2008-04-15 US claimed
US-20070032484-A1 Cathepsin K inhibitors ROCHE PALO ALTO LLC 2007-02-08 US claimed
US-7358373-B2 Cathepsin K inhibitors ROCHE PALO ALTO LLC (US) 2008-04-15 US disclosed
US-20070032484-A1 Cathepsin K inhibitors ROCHE PALO ALTO LLC 2007-02-08 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-20070032484-A1 Cathepsin K inhibitors CTSK, CTSS, CTSF L3MBTL1 2741/4885PKM 2477/4885CTSB 5/4885

“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.