SCHEMBL4199905

SCHEMBL4199905

Cn1ncc(C(=O)NCCCCO[Si](C)(C)C(C)(C)C)c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 1/20 0.34
NR3C1 P04150 1/20 0.33
HCRTR1 O43613 1/20 0.33
DRD2 P14416 3/20 0.33
DRD1 P21728 3/20 0.33
DRD4 P21917 3/20 0.33
HTR2A P28223 3/20 0.33
DRD3 P35462 3/20 0.33
HTR1A P08908 2/20 0.33
ADRA1D P25100 2/20 0.33
HTR2C P28335 2/20 0.33
ADRA1A P35348 2/20 0.33
ADRA1B P35368 2/20 0.33
HTR2B P41595 2/20 0.33
TP53 P04637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
DUT P33316 1/20 0.33

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
SCHEMBL4206941 0.84 HTT (0.41) ALDH1A1MAPTNR3C1MEN1KMT2A
SCHEMBL4199899 0.77 DUT (0.32) DUT
SCHEMBL17853170 0.73 KDM4C (0.42) ALDH1A1MAPTNR3C1
SCHEMBL3125792 0.71 NR3C1 (0.34) ALDH1A1MAPTNR3C1MAPK14
SCHEMBL4204205 0.71 ALDH1A1 (0.41) ALDH1A1MAPTKMT2A
SCHEMBL17853169 0.71 ALDH1A1 (0.51) ALDH1A1MAPTLMNAKMT2AHTT
SCHEMBL6065942 0.70 VNN1 (0.34) ALDH1A1NR3C1
SCHEMBL27661737 0.69 VNN1 (0.34) ALDH1A1NR3C1KMT2A
SCHEMBL5148605 0.69 SIGMAR1 (0.43) DRD2MEN1KMT2A
SCHEMBL30807261 0.68 SMN1; SMN2 (0.57) ALDH1A1HTR2ADRD3HTR1AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012054-A1 Cephem Compounds and Use as Antimicrobial Agents ASTELLAS PHARMA INC. (JP) 2009-01-08 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-20090012054-A1 Cephem Compounds and Use as Antimicrobial Agents CEP170, Q6ZSR9, H1-10 ALDH1A1 3781/4885MAPT 4139/4885LMNA 3203/4885

“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.