SCHEMBL19971350

SCHEMBL19971350

NC(=O)OCCc1cn(S(=O)(=O)c2cccc(F)c2)c2nc(Nc3ccc(Cl)nc3Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDE P14735 1/20 0.35
HTR6 P50406 4/20 0.32
RORC P51449 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
SCHEMBL19971351 0.85 HTR6 (0.33) IDEHTR6
SCHEMBL28068049 0.85 HTR6 (0.35) IDEHTR6
SCHEMBL16626801 0.83 HTR6 (0.36) IDEHTR6
Hydrochloric Acid SCHEMBL16619116 0.83 HTR6 (0.35) IDEHTR6
SCHEMBL16618986 0.82 HDAC1 (0.34) IDEHTR6
SCHEMBL16626800 0.81 HDAC1 (0.33) IDEHTR6
SCHEMBL16626788 0.69 HTR6 (0.39) IDEHTR6
SCHEMBL17971552 0.69 HTR6 (0.41) IDEHTR6
Hydrochloric Acid SCHEMBL16619073 0.69 HTR6 (0.38) IDEHTR6
Hydrochloric Acid SCHEMBL16619279 0.68 HTR6 (0.41) IDEHTR6

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
EP-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP claimed