SCHEMBL10248015

SCHEMBL10248015

O=C(c1ncccn1)c1ccccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BDKRB1 P46663 5/20 0.56
▸ CCR9 P51686 2/20 0.54
▸ SLC40A1 Q9NP59 4/20 0.54
▸ G6PD P11413 1/20 0.54
▸ NFKBIA P25963 1/20 0.54
▸ AGTR1 P30556 1/20 0.54
▸ METAP2 P50579 1/20 0.54
▸ METAP1 P53582 1/20 0.54
▸ GLO1 Q04760 1/20 0.54
▸ PAX8 Q06710 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ KMT2A Q03164 3/20 0.53
▸ TSHR P16473 1/20 0.53
▸ KDM4E B2RXH2 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ MMP2 P08253 2/20 0.49

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
SCHEMBL10251853 0.86 BDKRB1 (0.74) BDKRB1CCR9SLC40A1G6PDNFKBIA
SCHEMBL10248046 0.82 KMT2A (0.48) BDKRB1SLC40A1METAP2KMT2ATSHR
SCHEMBL31305 0.81 BDKRB1 (0.72) BDKRB1METAP2KMT2ATSHRKDM4E
SCHEMBL12220860 0.81 SLC40A1 (0.71) SLC40A1G6PDNFKBIAAGTR1METAP2
SCHEMBL10248265 0.81 BDKRB1 (0.73) BDKRB1CCR9KMT2AALDH1A1
SCHEMBL12220831 0.80 MCL1 (0.60) BDKRB1SLC40A1G6PDNFKBIAAGTR1
SCHEMBL13146414 0.80 ALDH1A1 (0.61) BDKRB1METAP2METAP1KMT2ATSHR
SCHEMBL10248276 0.80 BDKRB1 (0.57) BDKRB1CCR9SLC40A1G6PDNFKBIA
SCHEMBL10248358 0.80 GRM4 (0.56) BDKRB1SLC40A1G6PDNFKBIAAGTR1
SCHEMBL15306470 0.80 SLC40A1 (0.49) BDKRB1SLC40A1G6PDNFKBIAAGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9890148-B2 Aryl sulfonamides CHEMOCENTRYX, INC. (US) 2018-02-13 — — US disclosed
US-20150080351-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. 2015-03-19 — — US disclosed
US-20130267492-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. (US) 2013-10-10 — — US disclosed
US-20120014997-A1 ARYL SULFONAMIDES UNGASHE SOLOMON (US) 2012-01-19 — — US disclosed
US-20090163498-A1 Aryl Sulfonamides CHEMOCENTRYX, INC. (US) 2009-06-25 — — US disclosed
US-7420055-B2 Antagonists of the chemokine receptor 9 (CCR9); inhibit TECK ligand; antiinflammatory agents and immunoregulators; inflammatory bowel disease; (2-phenylsulfonamidophenyl)-pyridinyl-methanones; N-[4-chloro-2(pyridine4-carbonyl)-phenyl]4-morpholin-4-yl-benzenesulfonamide CHEMOCENTRYX, INC. (US) 2008-09-02 — — US 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 (4 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-20120014997-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 BDKRB1 429/4885CCR9 1/4885SLC40A1 2953/4885
US-20150080351-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 BDKRB1 429/4885CCR9 1/4885SLC40A1 2953/4885
US-20090163498-A1 Aryl Sulfonamides CCR9, CCR1, CCR2 BDKRB1 429/4885CCR9 1/4885SLC40A1 2953/4885
US-20130267492-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 BDKRB1 429/4885CCR9 1/4885SLC40A1 2953/4885

“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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