SCHEMBL1999141

SCHEMBL1999141

CS(=O)(=O)OCC1CCn2c(cc3ccccc32)C1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.40
HTR2C P28335 5/20 0.40
SIGMAR1 Q99720 11/20 0.39
PRKCE Q02156 2/20 0.39
MYLK Q15746 2/20 0.39
HTR1A P08908 1/20 0.34

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
SCHEMBL8448934 1.00 HTR2A (0.40) HTR2AHTR2CSIGMAR1PRKCEMYLK
SCHEMBL6015848 0.81 SIGMAR1 (0.44) HTR2AHTR2CSIGMAR1PRKCEMYLK
SCHEMBL8319222 0.81 SIGMAR1 (0.44) HTR2AHTR2CSIGMAR1PRKCEMYLK
SCHEMBL8323489 0.79 HTR2A (0.36) HTR2AHTR2CSIGMAR1HTR1A
SCHEMBL8323502 0.79 HTR2A (0.36) HTR2AHTR2CSIGMAR1HTR1A
SCHEMBL8323495 0.79 HTR2A (0.36) HTR2AHTR2CSIGMAR1HTR1A
SCHEMBL1998037 0.76 HTR2A (0.39) HTR2AHTR2CSIGMAR1PRKCEMYLK
SCHEMBL8318760 0.76 HTR2A (0.48) HTR2AHTR2CSIGMAR1PRKCEMYLK
SCHEMBL8324461 0.76 HTR2A (0.48) HTR2AHTR2CSIGMAR1PRKCEMYLK
SCHEMBL8655904 0.76 PRKCE (0.51) HTR2AHTR2CSIGMAR1PRKCEMYLK

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
WO-2011079105-A1 NOVEL THIENOPYRROLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-30 WO disclosed
US-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-23 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-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS TPMT, TSLP, THPO HTR2A 1080/4885HTR2C 648/4885SIGMAR1 512/4885

“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.