SCHEMBL1663997

SCHEMBL1663997

Cc1ccc(O[Si](C(C)C)(C(C)C)C(C)C)cc1NC(=O)[C@@H](C)NC(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MAPT P10636 1/20 0.47
OPRK1 P41145 1/20 0.47
MME P08473 1/20 0.46
ECE1 P42892 1/20 0.46
CTSK P43235 4/20 0.46
CYP1A2 P05177 1/20 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
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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 0.89 CTSK (0.45) NPC1RAB9AMMEECE1CTSK
SCHEMBL1663905 0.89 CTSK (0.45) NPC1RAB9AMMEECE1CTSK
SCHEMBL1663999 0.75 CTSK (0.53) CTSKCTSLCTSBCTSSATM
SCHEMBL11415968 0.75 CTSK (0.56) NPC1RAB9ACTSKCYP1A2CTSL
SCHEMBL11055593 0.74 MEN1 (0.61) NPC1RAB9AMAPTOPRK1CTSK
SCHEMBL9414189 0.74 CTSK (0.55) NPC1RAB9AMMEECE1CTSK
SCHEMBL9414187 0.74 CTSK (0.55) NPC1RAB9AMMEECE1CTSK
SCHEMBL7421757 0.73 CTSK (0.62) MMEECE1CTSKCYP1A2CTSL
SCHEMBL10954146 0.73 CTSK (0.62) MMEECE1CTSKCYP1A2CTSL
SCHEMBL8177898 0.73 CTSK (0.62) MMEECE1CTSKCYP1A2CTSL

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 5 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
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 NPC1 1251/4885RAB9A 566/4885MAPT 2714/4885

“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.