SCHEMBL16626800

SCHEMBL16626800

CN(Cc1cn(S(=O)(=O)c2cccc(F)c2)c2nc(Nc3ccc(Cl)nc3Cl)ccc12)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
PTGER2 P43116 2/20 0.32
HTR6 P50406 4/20 0.32
IDE P14735 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
KAT8 Q9H7Z6 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL16618986 0.90 HDAC1 (0.34) HDAC1HDAC2HDAC6PTGER2HTR6
SCHEMBL28068049 0.84 HTR6 (0.35) HTR6IDEHTR2A
SCHEMBL19971351 0.83 HTR6 (0.33) HTR6IDEHTR2A
SCHEMBL16626801 0.82 HTR6 (0.36) HTR6IDEHTR2AHTR2C
SCHEMBL16626799 0.82 HTR6 (0.36) HDAC1HDAC2HDAC6PTGER2HTR6
Hydrochloric Acid SCHEMBL16619116 0.82 HTR6 (0.35) HTR6IDEHTR2AHTR2C
SCHEMBL19971350 0.81 IDE (0.35) HTR6IDE
SCHEMBL16626798 0.77 TTK (0.39) HDAC1HDAC2HDAC6HTR6KAT8
SCHEMBL16626507 0.74 HDAC1 (0.38) HDAC1HDAC2HDAC6HTR6IDE
SCHEMBL16626488 0.74 HTR6 (0.42) HDAC1HDAC2HDAC6HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP disclosed
US-9676714-B2 Sulfonylindole derivatives and method for preparing the same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2017-06-13 US disclosed
US-9676714-B2 Sulfonylindole derivatives and method for preparing the same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2017-06-13 US disclosed
US-20160221946-A1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2016-08-04 US disclosed
US-20160221946-A1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2016-08-04 US disclosed
WO-2015050412-A1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2015-04-09 WO 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-20160221946-A1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME GIPR, PGC, SI HDAC1 2895/4885HDAC2 1630/4885HDAC6 3570/4885

“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.