SCHEMBL1663889

SCHEMBL1663889

CC(C)c1nc2cc(O)ccc2c(=O)n1-c1ccccn1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.57
ESR1 P03372 3/20 0.46
ESR2 Q92731 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 1/20 0.42
DPP4 P27487 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAT2A P31153 2/20 0.39
HSD17B10 Q99714 1/20 0.38
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.37
NQO1 P15559 1/20 0.37
POLB P06746 1/20 0.37
AKR1B1 P15121 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
SCHEMBL1664648 0.84 TRPV1 (0.56) TRPV1ESR1ESR2ALDH1A1SMN1; SMN2
SCHEMBL1663110 0.81 TRPV1 (0.57) TRPV1ESR1ESR2ALDH1A1SMN1; SMN2
SCHEMBL1665874 0.80 TRPV1 (0.54) TRPV1ESR1ESR2ALDH1A1SMN1; SMN2
SCHEMBL1663160 0.79 TRPV1 (0.53) TRPV1ESR1ESR2ALDH1A1HTT
SCHEMBL1665294 0.79 TRPV1 (0.70) TRPV1ESR1ESR2ALDH1A1SMN1; SMN2
SCHEMBL1663953 0.78 TRPV1 (0.57) TRPV1ESR1ESR2ALDH1A1HTT
SCHEMBL1664030 0.78 TRPV1 (0.57) TRPV1ESR1ESR2ALDH1A1HSD17B10
SCHEMBL1664223 0.76 TRPV1 (0.55) TRPV1ESR1ESR2ALDH1A1HTT
SCHEMBL1664439 0.76 TRPV1 (0.74) TRPV1ESR1ESR2ALDH1A1HTT
SCHEMBL1666196 0.76 TRPV1 (0.63) TRPV1ESR1ESR2ALDH1A1SMN1; SMN2

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 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.