SCHEMBL18607993

SCHEMBL18607993

CCN1CCCCCC1O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.36
ALDH1A1 P00352 2/20 0.35
SHBG P04278 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CHRM5 P08912 1/20 0.33
ADRA2C P18825 1/20 0.33
KMT2A Q03164 1/20 0.33
ADRA1D P25100 1/20 0.32
ADRA1A P35348 1/20 0.32
ADRA1B P35368 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL6628245 0.98
SCHEMBL8430009 0.91
SCHEMBL2038268 0.91
SCHEMBL27675556 0.80 GBA1 (0.43) GAA
Tert-Butyl Formate SCHEMBL28757902 0.78 TDP1 (0.39) ALDH1A1ADRA1DADRA1AADRA1B
SCHEMBL4229106 0.77 GBA2 (0.46) KMT2AGAA
SCHEMBL8014534 0.76
SCHEMBL2850065 0.75 S1PR1 (0.47) GAA
SCHEMBL28706759 0.75 ADRA1D (0.32) ALDH1A1L3MBTL1KMT2AADRA1DADRA1A
SCHEMBL1110101 0.74 ALDH1A1 (0.46) ALDH1A1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3210947-A1 METHOD OF MANUFACTURING AN ETCHED GLASS ARTICLE AGFA-GEVAERT (BE) 2017-08-30 EP disclosed
US-20170065512-A1 Film Forming Composition THE PROCTER & GAMBLE COMPANY 2017-03-09 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-20170065512-A1 Film Forming Composition AGPAT5, AGPAT2, ACR HSD11B1 3663/4885ALDH1A1 1357/4885SHBG 1558/4885

“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.