SCHEMBL16235224

SCHEMBL16235224

COc1cc(Cl)nnc1NS(=O)(=O)c1cc(Cl)sc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S100A9 P06702 4/20 0.49
▸ CDK1 P06493 1/20 0.48
▸ CCNB1 P14635 1/20 0.48
▸ CCNA2 P20248 1/20 0.48
▸ CCND1 P24385 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ CDK7 P50613 1/20 0.48
▸ CCNH P51946 1/20 0.48
▸ CCNA1 P78396 1/20 0.48
▸ CDK6 Q00534 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.42
▸ PFKFB3 Q16875 1/20 0.42
▸ ACLY P53396 1/20 0.40
▸ APP P05067 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ SGK1 O00141 1/20 0.37
▸ CCR4 P51679 1/20 0.37
▸ EDNRA P25101 1/20 0.37
▸ KAT6A Q92794 1/20 0.36
▸ TYMS P04818 1/20 0.36

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
SCHEMBL16235919 0.80 S100A9 (0.52) S100A9CDK1CCNB1CCNA2CCND1
SCHEMBL16235444 0.80 SMN1; SMN2 (0.33) S100A9CDK1CCNB1CCNA2CCND1
SCHEMBL5737260 0.80 SMN1; SMN2 (0.60) SMN1; SMN2CCR4CCR5
SCHEMBL28163264 0.79 S100A9 (0.46) S100A9CDK1CCNB1CCNA2CCND1
SCHEMBL17472686 0.79 CCR4 (0.47) S100A9CDK1CCNB1CCNA2CCND1
SCHEMBL28053283 0.77 S100A9 (0.42) S100A9CDK1CCNB1CCNA2CCND1
SCHEMBL16234953 0.76 ALPL (0.46) S100A9CDK1CCNB1CCNA2CCND1
SCHEMBL5736375 0.76 CCR4 (0.59) CCR4
SCHEMBL28053284 0.74 TDP1 (0.43) S100A9CDK1CCNB1CCNA2CCND1
SCHEMBL16235429 0.72 ALPL (0.45) ACLYCCR4

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 S100A9 1/4885CDK1 2469/4885CCNB1 2899/4885
US-20180155330-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS S100A9, S100B, S100A10 S100A9 1/4885CDK1 2469/4885CCNB1 2899/4885
US-20160115158-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS S100A9, S100A4, S100B S100A9 1/4885CDK1 2339/4885CCNB1 3119/4885

“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.

Send feedback