SCHEMBL5459718

SCHEMBL5459718

CN(C)c1ccc(CNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4NC2CCCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RB1 P06400 6/20 0.51
MAPT P10636 7/20 0.45
LMNA P02545 4/20 0.45
ALDH1A1 P00352 3/20 0.45
MAPK1 P28482 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TP53 P04637 2/20 0.43
CASP1 P29466 1/20 0.43
PDE4B Q07343 1/20 0.43
BRD3 Q15059 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HTT P42858 1/20 0.42
GAA P10253 1/20 0.40
CASP6 P55212 1/20 0.40
ALOX15 P16050 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL5456622 0.89 RB1 (0.61) RB1MAPTLMNAALDH1A1MAPK1
SCHEMBL5460539 0.88 PDE4B (0.53) RB1MAPTLMNAALDH1A1TP53
SCHEMBL5454075 0.87 RB1 (0.53) RB1MAPTALDH1A1MAPK1TP53
SCHEMBL14361170 0.86 RB1 (0.51) RB1MAPTLMNAALDH1A1MAPK1
SCHEMBL5456566 0.85 RB1 (0.56) RB1MAPTMAPK1MEN1KMT2A
SCHEMBL5451949 0.85 RB1 (0.56) RB1MAPTMAPK1MEN1KMT2A
SCHEMBL5456919 0.84 PARP1 (0.52) RB1MAPTALDH1A1MAPK1TP53
SCHEMBL5451412 0.84 RB1 (0.56) RB1MAPTMAPK1MEN1KMT2A
SCHEMBL5454765 0.83 RB1 (0.53) RB1MAPTLMNAALDH1A1KMT2A
SCHEMBL5454039 0.83 RB1 (0.53) RB1MAPTLMNAALDH1A1KMT2A

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 RB1 1821/4885MAPT 3817/4885LMNA 4432/4885

“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.