SCHEMBL1817504

SCHEMBL1817504

CC(=O)Nc1cnc(S(=O)(=O)Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.47
ALDH1A1 P00352 3/20 0.42
IDO1 P14902 2/20 0.42
ATM Q13315 1/20 0.39
ATAD2 Q6PL18 1/20 0.39
CECR2 Q9BXF3 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
PTK2 Q05397 1/20 0.38
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.38
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL1819956 0.84 ALDH1A1 (0.45) RORCALDH1A1IDO1SMN1; SMN2LMNA
SCHEMBL1816036 0.83 IDO1 (0.39) RORCALDH1A1IDO1LMNAL3MBTL1
SCHEMBL1817314 0.82 HPGD (0.40) RORCALDH1A1LMNAL3MBTL1POLB
SCHEMBL1818124 0.81 GAA (0.50) RORCALDH1A1SMN1; SMN2LMNAL3MBTL1
SCHEMBL31311192 0.79 KMT2A (0.38) RORCALDH1A1IDO1POLB
SCHEMBL1008664 0.78 RORC (0.52) RORCALDH1A1SMN1; SMN2PTK2LMNA
SCHEMBL31311285 0.77 RORC (0.44) RORCALDH1A1SMN1; SMN2LMNATP53
SCHEMBL28134648 0.77 RORC (0.51) RORCALDH1A1SMN1; SMN2PTK2LMNA
SCHEMBL21598720 0.75 MALT1 (0.44) RORCALDH1A1IDO1ATMATAD2
SCHEMBL1675548 0.72 RORC (0.47) RORCALDH1A1IDO1SMN1; SMN2PTK2

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
US-20110212918-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
WO-2011060199-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2011-05-19 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-20110212918-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BCL6, BTD RORC 1616/4885ALDH1A1 4190/4885IDO1 3398/4885

“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.