SCHEMBL16235057

SCHEMBL16235057

COc1cc(Cl)cnc1NS(=O)(=O)c1cncc(-c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 4/20 0.47
▸ S100A9 P06702 1/20 0.46
▸ ALPL P05186 7/20 0.45
▸ PIK3CD O00329 1/20 0.44
▸ PIK3CA P42336 1/20 0.44
▸ PIK3CB P42338 1/20 0.44
▸ PIK3CG P48736 1/20 0.44
▸ PTGES2 Q9H7Z7 1/20 0.43
▸ APLNR P35414 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ PIK3C3 Q8NEB9 1/20 0.42
▸ CCR4 P51679 2/20 0.42
▸ POLB P06746 1/20 0.41

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
SCHEMBL16235618 0.83 S100A9 (0.67) ACLYS100A9PIK3CDPIK3CAPIK3CB
SCHEMBL16234982 0.81 S100A9 (0.68) S100A9APLNRHTTCCR4POLB
SCHEMBL31085814 0.81 ACLY (0.43) ACLYPIK3CAHTTCCR4POLB
SCHEMBL16235121 0.76 ALDH1A1 (0.50) HTTCCR4
SCHEMBL16235782 0.76 ALDH1A1 (0.53) S100A9HTTCCR4POLB
SCHEMBL20212362 0.76 S100A9 (0.60) S100A9APLNRHTTCCR4POLB
SCHEMBL16235973 0.74 S100A9 (0.53) S100A9HTTCCR4
SCHEMBL16235038 0.74 S100A9 (0.61) S100A9HTTCCR4
SCHEMBL16235095 0.73 CCR4 (0.42) S100A9HTTCCR4POLB
SCHEMBL16235492 0.72 CCR4 (0.43) S100A9PIK3CAHTTCCR4

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 ACLY 4724/4885S100A9 1/4885ALPL 2152/4885
US-20180155330-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS S100A9, S100B, S100A10 ACLY 4724/4885S100A9 1/4885ALPL 2152/4885
US-20160115158-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS S100A9, S100A4, S100B ACLY 4827/4885S100A9 1/4885ALPL 2767/4885

“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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