SCHEMBL5449796

SCHEMBL5449796

CCNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3NCC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD3 Q15059 8/20 0.54
GAA P10253 2/20 0.49
CASP6 P55212 1/20 0.49
MAPT P10636 3/20 0.46
PRMT5 O14744 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TP53 P04637 1/20 0.46
CASP1 P29466 1/20 0.46
CDC42 P60953 1/20 0.46
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SIRT1 Q96EB6 2/20 0.44
RAB9A P51151 1/20 0.44
RECQL P46063 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL5451949 0.86 RB1 (0.56) BRD3GAACASP6MAPTHTT
SCHEMBL5456566 0.86 RB1 (0.56) BRD3GAACASP6MAPTHTT
SCHEMBL5453990 0.85 GAA (0.55) BRD3GAACASP6MAPTPRMT5
SCHEMBL5451412 0.85 RB1 (0.56) BRD3GAACASP6MAPTHTT
SCHEMBL5456608 0.85 GAA (0.54) BRD3GAACASP6MAPTPRMT5
SCHEMBL5455124 0.84 GAA (0.53) BRD3GAACASP6MAPTPRMT5
SCHEMBL5445912 0.84 CDC42 (0.52) BRD3GAACASP6MAPTPRMT5
SCHEMBL5468069 0.83 RB1 (0.55) BRD3GAACASP6MAPTTP53
SCHEMBL5446986 0.83 ALDH1A1 (0.49) BRD3GAANPSR1CDC42SMN1; SMN2
SCHEMBL5461112 0.82 BRD3 (0.54) BRD3GAACASP6MAPTPRMT5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 US disclosed
US-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 US disclosed
US-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 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-20070276009-A1 Compositions and Methods for Viral Inhibition MAVS, SARS1, ZC3HAV1 BRD3 529/4885GAA 1417/4885CASP6 3264/4885

“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.