SCHEMBL16235782

SCHEMBL16235782

COc1cc(Cl)cnc1NS(=O)(=O)c1cnc(Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ LMNA P02545 3/20 0.50
▸ POLB P06746 1/20 0.50
▸ HTT P42858 2/20 0.47
▸ CCR4 P51679 6/20 0.45
▸ S100A9 P06702 3/20 0.43
▸ MITF O75030 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ PABPC1 P11940 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL16235973 0.88 S100A9 (0.53) ALDH1A1LMNAHTTCCR4S100A9
SCHEMBL16235095 0.85 CCR4 (0.42) ALDH1A1NPSR1MAPTLMNAPOLB
SCHEMBL16235121 0.82 ALDH1A1 (0.50) ALDH1A1MAPTLMNAHTTCCR4
SCHEMBL16235038 0.81 S100A9 (0.61) HTTCCR4S100A9
SCHEMBL16234982 0.80 S100A9 (0.68) POLBHTTCCR4S100A9MEN1
SCHEMBL16235072 0.79 S100A9 (0.45) ALDH1A1HTTCCR4S100A9KMT2A
SCHEMBL16235370 0.78 S100A9 (0.40) ALDH1A1LMNAHTTCCR4S100A9
SCHEMBL16235255 0.78 S100A9 (0.53) ALDH1A1LMNAPOLBHTTCCR4
SCHEMBL16235492 0.78 CCR4 (0.43) ALDH1A1LMNAHTTCCR4S100A9
SCHEMBL16235198 0.77 CCR4 (0.39) ALDH1A1MAPTLMNAHTTCCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10125125-B2 N-(heteroaryl)-sulfonamide derivatives useful as S100-inhibitors ACTIVE BIOTECH AB (SE) 2018-11-13 — — US disclosed
US-20180155330-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS ACTIVE BIOTECH AB (SE) 2018-06-07 — — US disclosed
US-9873687-B2 N-(heteroaryl)-sulfonamide derivatives useful as S100-inhibitors ACTIVE BIOTECH AB (SE) 2018-01-23 — — US disclosed
US-20160115158-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS ACTIVE BIOTECH AB (SE) 2016-04-28 — — US disclosed
EP-2925743-B1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS ACTIVE BIOTECH AB (SE) 2016-02-03 — — EP disclosed
EP-2925743-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS Active Biotech AB (SE) 2015-10-07 — — EP disclosed
WO-2014184234-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS ACTIVE BIOTECH AB (SE) 2014-11-20 — — 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 (3 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-10125125-B2 N-(heteroaryl)-sulfonamide derivatives useful as S100-inhibitors S100A9, S100B, S100A10 ALDH1A1 4109/4885NPSR1 1647/4885MAPT 380/4885
US-20180155330-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS S100A9, S100B, S100A10 ALDH1A1 4109/4885NPSR1 1647/4885MAPT 380/4885
US-20160115158-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS S100A9, S100A4, S100B ALDH1A1 4370/4885NPSR1 1917/4885MAPT 311/4885

“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.

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