SCHEMBL1663939

SCHEMBL1663939

COc1cc2c(=O)n(-c3ccc(Cl)cc3)c(C(C)C)nc2cc1O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.49
ESR2 Q92731 1/20 0.49
TRPV1 Q8NER1 1/20 0.48
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
PDE10A Q9Y233 2/20 0.42
KDM4E B2RXH2 1/20 0.41
KDR P35968 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
SCHEMBL1663040 0.88 ESR1 (0.55) ESR1ESR2TRPV1TP53MAPT
SCHEMBL1663398 0.80 TRPV1 (0.72) ESR1ESR2TRPV1SMN1; SMN2PDE10A
SCHEMBL1664018 0.77 ESR1 (0.49) ESR1ESR2TRPV1TP53MAPT
SCHEMBL1665818 0.77 SMN1; SMN2 (0.47) ESR1ESR2TP53MAPTSMN1; SMN2
SCHEMBL1663858 0.76 TRPV1 (0.55) ESR1ESR2TRPV1MAPTSMN1; SMN2
SCHEMBL12605322 0.76 SMN1; SMN2 (0.44) ESR1ESR2TRPV1SMN1; SMN2PDE10A
SCHEMBL1662878 0.75 ESR2 (0.84) ESR1ESR2TRPV1KDM4E
SCHEMBL1663337 0.74 NPC1 (0.56) ESR1ESR2TRPV1TP53MAPT
SCHEMBL10446394 0.74 TRPV1 (0.52) ESR1ESR2TRPV1SMN1; SMN2KDM4E
SCHEMBL11931941 0.73 TRPV1 (0.52) ESR1ESR2TRPV1MAPTSMN1; 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 ESR1 1321/4885ESR2 2159/4885TRPV1 1/4885

“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.