SCHEMBL1663386

SCHEMBL1663386

COc1cc(N)c(C(=O)Nc2ccc(Cl)cc2)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.51
▸ KMT2A Q03164 6/20 0.51
▸ MAPT P10636 2/20 0.51
▸ ALDH1A1 P00352 3/20 0.49
▸ HDAC8 Q9BY41 1/20 0.49
▸ PNLIP P16233 1/20 0.47
▸ CNR1 P21554 2/20 0.46
▸ P2RX1 P51575 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ SCN9A Q15858 3/20 0.45
▸ SCN5A Q14524 2/20 0.45
▸ HTR1A P08908 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45
▸ DRD1 P21728 1/20 0.45
▸ HTR2A P28223 1/20 0.45
▸ ADORA2A P29274 1/20 0.45
▸ OPRM1 P35372 1/20 0.45

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
SCHEMBL14013167 0.91 NPC1 (0.54) MEN1KMT2AMAPTALDH1A1HDAC8
SCHEMBL12799393 0.89 NPC1 (0.46) MEN1KMT2AMAPTALDH1A1HDAC8
SCHEMBL14516417 0.87 ALDH1A1 (0.49) MEN1KMT2AMAPTALDH1A1HDAC8
SCHEMBL14176438 0.85 SMN1; SMN2 (0.51) MEN1KMT2AMAPTALDH1A1PNLIP
SCHEMBL14176439 0.82 SMN1; SMN2 (0.50) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL14176441 0.80 MAPT (0.55) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL1662851 0.78 MAOB (0.58) MEN1KMT2AMAPTALDH1A1HDAC8
SCHEMBL4074716 0.77 TAS1R3 (0.56) MEN1KMT2AMAPTNPC1SMN1; SMN2
SCHEMBL31710349 0.76 MEN1 (0.60) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL6813395 0.76 HDAC8 (0.64) MEN1KMT2AMAPTALDH1A1HDAC8

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 9 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
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
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
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 MEN1 4252/4885KMT2A 3561/4885MAPT 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.

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