SCHEMBL1663333

SCHEMBL1663333

CCc1ccc(-n2c(C(C)C)nc3cc(O)ccc3c2=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.69
ESR1 P03372 8/20 0.58
ESR2 Q92731 7/20 0.58
KCNH2 Q12809 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 2/20 0.40
TP53 P04637 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HCAR1 Q9BXC0 1/20 0.38
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL1664439 0.86 TRPV1 (0.74) TRPV1ESR1ESR2KCNH2HRH3
SCHEMBL1663398 0.85 TRPV1 (0.72) TRPV1ESR1ESR2KCNH2HRH3
SCHEMBL1664011 0.85 TRPV1 (0.72) TRPV1ESR1ESR2KCNH2HRH3
SCHEMBL10446158 0.85 TRPV1 (0.72) TRPV1ESR1ESR2KCNH2HRH3
SCHEMBL1665294 0.84 TRPV1 (0.70) TRPV1ESR1ESR2KCNH2HRH3
SCHEMBL1663409 0.83 TRPV1 (0.69) TRPV1ESR1ESR2KCNH2HRH3
Alcohol SCHEMBL26655335 0.83 TRPV1 (0.91) TRPV1ESR1ESR2KCNH2HRH3
SCHEMBL1663637 0.82 TRPV1 (0.65) TRPV1ESR1ESR2KCNH2HRH3
SCHEMBL10445948 0.82 TRPV1 (0.68) TRPV1ESR1ESR2KCNH2HRH3
SCHEMBL1066896 0.82 TRPV1 (1.00) TRPV1ESR1ESR2KCNH2HRH3

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
CN-101356160-A Trisubstituted quinazolinone derivatives as vanilloid antagonists JANSSEN PHARMACEUTICA NV (CH) 2009-01-28 CN 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 TRPV1 1/4885ESR1 1321/4885ESR2 2159/4885

“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.