SCHEMBL1663674

SCHEMBL1663674

CC(C)[Si](Oc1ccc(C(=O)Nc2ccc(Cl)cc2)c(N)c1)(C(C)C)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.47
HDAC1 Q13547 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
PNLIP P16233 4/20 0.43
NPC1 O15118 3/20 0.43
P2RX1 P51575 1/20 0.43
TSHR P16473 1/20 0.43
JAK2 O60674 1/20 0.42
TYK2 P29597 1/20 0.42
MAOB P27338 2/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
FADS1 O60427 1/20 0.41
ABL1 P00519 1/20 0.41
OPRL1 P41146 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
SCHEMBL1662851 0.82 MAOB (0.58) BRAFHDAC1PNLIPNPC1P2RX1
SCHEMBL1663051 0.82 POLB (0.49) SMN1; SMN2NPC1P2RX1ALDH1A1LMNA
SCHEMBL1663832 0.80 SMN1; SMN2 (0.40) SMN1; SMN2TAS1R3TAS1R1PNLIPNPC1
SCHEMBL1663492 0.76 ALDH1A1 (0.46) ALDH1A1GAAKMT2A
SCHEMBL2721899 0.74 MAPT (0.61) BRAFHDAC1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL15920940 0.72 KMT2A (0.69) HDAC1SMN1; SMN2NPC1P2RX1ALDH1A1
SCHEMBL6593295 0.72 P2RX1 (0.58) HDAC1SMN1; SMN2PNLIPNPC1P2RX1
SCHEMBL5534714 0.71 PRSS12 (0.54) BRAFHDAC1SMN1; SMN2NPC1P2RX1
SCHEMBL13936249 0.71 KLKB1 (0.56) BRAFHDAC1SMN1; SMN2NPC1JAK2
SCHEMBL5465425 0.71 TYK2 (0.42) JAK2TYK2MAOBALDH1A1RAB9A

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 6 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
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 BRAF 1466/4885HDAC1 999/4885SMN1; SMN2 4016/4885

“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.