SCHEMBL10247939

SCHEMBL10247939

Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2cc[n+]([O-])cc2C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 3/20 0.56
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
CCR9 P51686 4/20 0.49
CYP1A2 P05177 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CCR2 P41597 1/20 0.48
CYP2C9 P11712 2/20 0.48
GAA P10253 1/20 0.46
GFER P55789 1/20 0.46
FFAR4 Q5NUL3 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 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
SCHEMBL11930661 0.91 ALDH1A1 (0.49) METAP2LMNAHTTTP53MAPT
SCHEMBL10247932 0.80 CCR9 (0.64) METAP2LMNAHTTTP53MAPT
SCHEMBL10247996 0.80 METAP2 (0.55) METAP2LMNAHTTTP53MAPT
SCHEMBL12570805 0.79 METAP2 (0.86) METAP2LMNAHTTCYP1A2CCR2
SCHEMBL10251869 0.79 CCR9 (0.60) METAP2LMNAHTTTP53MAPT
SCHEMBL10248298 0.78 LMNA (0.56) METAP2LMNAHTTTP53MAPT
SCHEMBL14064582 0.78 CCR9 (0.66) METAP2LMNAHTTTP53MAPT
SCHEMBL10247933 0.76 CCR9 (0.64) METAP2LMNAHTTTP53MAPT
SCHEMBL12220857 0.76 LMNA (0.81) METAP2LMNAHTTTP53MAPT
SCHEMBL12909355 0.76 CYP2C9 (0.47) METAP2LMNAHTTTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 METAP2 2329/4885LMNA 4484/4885HTT 2647/4885
US-20150080351-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 METAP2 2329/4885LMNA 4484/4885HTT 2647/4885
US-20090163498-A1 Aryl Sulfonamides CCR9, CCR1, CCR2 METAP2 2329/4885LMNA 4484/4885HTT 2647/4885
US-20130267492-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 METAP2 2329/4885LMNA 4484/4885HTT 2647/4885

“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.