SCHEMBL1663905

SCHEMBL1663905

CC(NC(=O)OCc1ccccc1)C(=O)Nc1cc(O[Si](C(C)C)(C(C)C)C(C)C)ccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.45
CTSL P07711 1/20 0.44
CTSB P07858 1/20 0.44
CTSS P25774 1/20 0.44
ATM Q13315 1/20 0.43
TOP2A P11388 1/20 0.42
TOP2B Q02880 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
KMT2A Q03164 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
BACE1 P56817 4/20 0.42
CYP1A2 P05177 1/20 0.42
MME P08473 1/20 0.41
ECE1 P42892 1/20 0.41

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
SCHEMBL1663903 1.00 CTSK (0.45) CTSKCTSLCTSBCTSSATM
SCHEMBL1663997 0.89 NPC1 (0.47) CTSKCTSLCTSBCTSSATM
SCHEMBL1663999 0.74 CTSK (0.53) CTSKCTSLCTSBCTSSATM
SCHEMBL11055593 0.73 MEN1 (0.61) CTSKCTSLCTSBCTSSATM
SCHEMBL9414187 0.73 CTSK (0.55) CTSKCTSLCTSBCTSSATM
SCHEMBL9414189 0.73 CTSK (0.55) CTSKCTSLCTSBCTSSATM
SCHEMBL8908677 0.73 CTSK (0.52) CTSKCTSLCTSBCTSSATM
SCHEMBL14091122 0.71 CTSK (0.50) CTSKCTSLCTSBCTSSATM
SCHEMBL13325457 0.71 KMT2A (0.58) CTSKCTSLCTSBCTSSMEN1
SCHEMBL1663491 0.71 AKR1C3 (0.40) MEN1KMT2ARAB9A

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
EP-2305652-A2 Trisubstituted quinazolinone derivatives as vanilloid antagonists Novartis AG (CH) 2011-04-06 EP disclosed
US-20090082365-A1 Trisubstituted Quinazolinone Derivatives as Vanilloid Antagonists NOVARTIS AG 2009-03-26 US disclosed
EP-1963283-A2 TRISUBSTITUTED QUINAZOLINONE DERIVATIVES AS VANILLOID ANTAGONISTS Novartis AG (CH) 2008-09-03 EP disclosed
WO-2007065662-A2 TRISUBSTITUTED QUINAZOLINONE DERIVATIVES AS VANILLOID ANTAGONISTS NOVARTIS AG (CH) 2007-06-14 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-20090082365-A1 Trisubstituted Quinazolinone Derivatives as Vanilloid Antagonists TRPV1, TRPV3, TRPV5 CTSK 1773/4885CTSL 3899/4885CTSB 2991/4885

“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.