SCHEMBL7888147

SCHEMBL7888147

O=S(=O)(NC1CCCCC1)c1cccc2ccccc12

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.65
HTT P42858 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
ALDH1A1 P00352 3/20 0.62
LMNA P02545 1/20 0.62
MCOLN3 Q8TDD5 1/20 0.62
MAPT P10636 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
CCR8 P51685 1/20 0.54
NPY5R Q15761 1/20 0.54
EPHX2 P34913 1/20 0.52
KDM4E B2RXH2 2/20 0.51
RECQL P46063 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
BRD4 O60885 4/20 0.49

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
SCHEMBL12793172 0.86 ALDH1A1 (0.59) GAAHTTNPSR1ALDH1A1LMNA
SCHEMBL9015377 0.85 KDM4E (0.52) GAAHTTNPSR1ALDH1A1LMNA
SCHEMBL9015386 0.85 KDM4E (0.52) GAAHTTNPSR1ALDH1A1LMNA
SCHEMBL6205606 0.85 CCR8 (0.56) GAAHTTNPSR1ALDH1A1LMNA
SCHEMBL10174793 0.81 SLC6A9 (0.51) GAAHTTNPSR1ALDH1A1MAPT
SCHEMBL19392477 0.81 ALDH1A1 (0.56) GAAHTTNPSR1ALDH1A1LMNA
SCHEMBL810171 0.81 NPY5R (0.63) GAAHTTNPSR1ALDH1A1LMNA
SCHEMBL27900241 0.79 CCR8 (0.53) MEN1KMT2ACCR8RECQLBRD4
SCHEMBL1340237 0.79 HTT (0.70) GAAHTTNPSR1ALDH1A1LMNA
SCHEMBL15226084 0.79 ALDH1A1 (0.66) GAAHTTNPSR1ALDH1A1LMNA

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-20180093960-A1 METHOD OF INHIBITING APOLIPOPROTEIN-E EXPRESSION WHILE INCREASING EXPRESSION OF AT LEAST ONE OF LDL-RECEPTOR PROTEIN OR ABCA1 PROTEIN COMPRISING ADMINISTERING A SMALL COMPOUND MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2018-04-05 US disclosed
US-6168897-B1 PATTERNWISE-EXPOSING THE LAMINATED LAYER COMPRISING LIGHT SENSITIVE LAYER AND FLUORESCENT LIGHT-GENERATING LAYER TO ELECTROMAGNETIC RADIATION AND AN ELECTRON BEAM TO GENERATE A FLUORESCENT LIGHT CAUSING PHOTOCHEMICAL REACTION, DEVELOPING KABUSHIKI KAISHA TOSHIBA (JP) 2001-01-02 US disclosed
US-5928841-A Method of photoetching at 180 to 220 KABUSHIKI KAISHA TOSHIBA (JP) 1999-07-27 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-20180093960-A1 METHOD OF INHIBITING APOLIPOPROTEIN-E EXPRESSION WHILE INCREASING EXPRESSION OF AT LEAST ONE OF LDL-RECEPTOR PROTEIN OR ABCA1 PROTEIN COMPRISING ADMINISTERING A SMALL COMPOUND LDLR, APOB, NR1H2 GAA 1729/4885HTT 2700/4885NPSR1 1432/4885

“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.