SCHEMBL7591530

SCHEMBL7591530

CCCOc1c(OCc2ccccc2)cccc1S(=O)(=O)CCC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 9/20 0.47
ADRA1D P25100 9/20 0.47
ADRA1A P35348 9/20 0.47
ADRA1B P35368 9/20 0.47
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PTAFR P25105 1/20 0.40
MGLL Q99685 1/20 0.39
LIPE Q05469 1/20 0.38
AR P10275 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38
PPARG P37231 1/20 0.38

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
SCHEMBL6942480 0.85 PTAFR (0.39) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL6944366 0.76 HTR1A (0.38) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL7595261 0.75 HTR1A (0.53) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL8710411 0.74 HTR6 (0.51) HTR1AADRA1DADRA1AADRA1BPTGES
SCHEMBL15922822 0.74 HTR1A (0.65) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL6943758 0.73 PTAFR (0.60) PTAFR
SCHEMBL6943291 0.73 PTAFR (0.53) MAPTPTAFR
SCHEMBL8369436 0.71 MAPT (0.49) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL28744247 0.70 F2 (0.48) HTR1AADRA1DADRA1AADRA1B
SCHEMBL4164605 0.70 MAPT (0.55) HTR1AMAPTMAPK1TDP1L3MBTL1

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-20020128491-A1 Method for synthesizing diaryl-substituted heterocyclic compounds, including tetrahydrofurans RAO ALLA VENKATA RAMA (IN) 2002-09-12 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-20020128491-A1 Method for synthesizing diaryl-substituted heterocyclic compounds, including tetrahydrofurans TPMT, TPI1, GTF2I HTR1A 751/4885ADRA1D 4212/4885ADRA1A 3966/4885

“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.