SCHEMBL13866118

SCHEMBL13866118

C[Si](C)(C)CCOCn1c(=O)c(-c2cccc3c(=O)[nH][nH]c23)nc2c(N)cccc21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.44
▸ FBP1 P09467 3/20 0.32
▸ EGFR P00533 1/20 0.31
▸ IGF1R P08069 1/20 0.31
▸ SRC P12931 1/20 0.31
▸ FLT4 P35916 1/20 0.31
▸ KDR P35968 1/20 0.31
▸ FLT3 P36888 1/20 0.31
▸ EPHB4 P54760 1/20 0.31
▸ TEK Q02763 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.31
▸ PARP1 P09874 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL13865866 0.78 MAPT (0.49) FBP1KDRMAPTTLR8PARP1
SCHEMBL13866116 0.76 NPC1 (0.41) NPC1FBP1MAPTTLR8ALDH1A1
SCHEMBL13866117 0.76 NPC1 (0.41) NPC1FBP1MAPTTLR8
SCHEMBL13866119 0.71 CDK4 (0.37) NPC1EGFRIGF1RSRCFLT4
SCHEMBL13866071 0.71 NPC1 (0.38) NPC1MAPTTLR8
SCHEMBL14176094 0.71 NPC1 (0.38) NPC1MAPTTLR8
SCHEMBL13866281 0.70 NPC1 (0.37) NPC1EGFRIGF1RSRCFLT4
SCHEMBL13866107 0.69 NPC1 (0.36) NPC1
SCHEMBL5669493 0.69 NPC1 (0.39) NPC1MAPTTLR8
SCHEMBL13865886 0.68 CDK4 (0.46) NPC1

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
US-20090137597-A1 Novel quinoxalinone derivatives MSD K.K. (JP) 2009-05-28 — — US disclosed
US-20090137597-A1 Novel quinoxalinone derivatives MSD K.K. (JP) 2009-05-28 — — US disclosed
US-7388010-B2 Quinoxalinone derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-06-17 — — US disclosed
US-7388010-B2 Quinoxalinone derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-06-17 — — US 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-20090137597-A1 Novel quinoxalinone derivatives NDUFB1, NDUFB6, NDUFB7 NPC1 1218/4885FBP1 268/4885EGFR 4609/4885

“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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