SCHEMBL16235415

SCHEMBL16235415

COc1ncc(Cl)cc1NS(=O)(=O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 3/20 0.55
▸ CCR2 P41597 6/20 0.50
▸ PTGES2 Q9H7Z7 4/20 0.48
▸ CYP3A4 P08684 3/20 0.47
▸ CYP2C9 P11712 3/20 0.47
▸ CYP2C19 P33261 3/20 0.47
▸ CCR4 P51679 3/20 0.47
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CCR5 P51681 1/20 0.46
▸ KEAP1 Q14145 1/20 0.46
▸ NFE2L2 Q16236 1/20 0.46
▸ PIK3CG P48736 1/20 0.45
▸ GLO1 Q04760 1/20 0.45
▸ CCR9 P51686 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ KIT P10721 1/20 0.44
▸ MAP3K20 Q9NYL2 1/20 0.44

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
SCHEMBL16235256 0.85 SLC40A1 (0.57) SLC40A1CCR2PTGES2CCR9KIT
SCHEMBL16235115 0.83 SLC40A1 (0.50) SLC40A1PTGES2CCR4GAAKIT
SCHEMBL15211940 0.81 PIK3CG (0.63) SLC40A1CCR2PTGES2CYP3A4CYP2C9
SCHEMBL10223383 0.79 CCR2 (0.52) SLC40A1CCR2PTGES2CYP3A4CYP2C9
SCHEMBL16235124 0.79 CCR2 (0.48) SLC40A1CCR2CYP3A4CYP2C9CYP2C19
SCHEMBL1957811 0.78 CCR2 (0.60) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL16235481 0.78 SLC40A1 (0.52) SLC40A1PTGES2CCR4CCR9KIT
SCHEMBL4902544 0.76 CCR2 (0.73) SLC40A1CCR2CYP3A4CYP2C9CYP2C19
SCHEMBL7591880 0.75 SLC40A1 (0.61) SLC40A1PTGES2KEAP1NFE2L2KIT
SCHEMBL4911328 0.75 CCR2 (0.71) SLC40A1CCR2CYP3A4CYP2C9CYP2C19

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 SLC40A1 370/4885CCR2 3405/4885PTGES2 2209/4885
US-20180155330-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS S100A9, S100B, S100A10 SLC40A1 370/4885CCR2 3405/4885PTGES2 2209/4885
US-20160115158-A1 N-(HETEROARYL)-SULFONAMIDE DERIVATIVES USEFUL AS S100-INHIBITORS S100A9, S100A4, S100B SLC40A1 751/4885CCR2 2820/4885PTGES2 1252/4885

“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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