SCHEMBL2616424

SCHEMBL2616424

Cc1ccc(C)c(NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.63
FFAR4 Q5NUL3 1/20 0.62
KMT2A Q03164 3/20 0.60
MAPT P10636 2/20 0.60
MEN1 O00255 2/20 0.60
ALDH1A1 P00352 2/20 0.56
CYP2C9 P11712 2/20 0.56
USP2 O75604 1/20 0.56
LMNA P02545 1/20 0.56
POLB P06746 1/20 0.56
CYP2C19 P33261 1/20 0.56
NOD2 Q9HC29 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KEAP1 Q14145 1/20 0.56
NFE2L2 Q16236 1/20 0.56
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA9 Q16790 2/20 0.55
CA4 P22748 1/20 0.55
CA7 P43166 1/20 0.55

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
SCHEMBL31681419 0.91 CA2 (0.60) METAP2KMT2AMAPTMEN1ALDH1A1
SCHEMBL7579963 0.88 METAP2 (0.69) METAP2FFAR4MAPTALDH1A1CYP2C9
SCHEMBL578654 0.86 FFAR4 (0.68) METAP2FFAR4KMT2AMAPTMEN1
SCHEMBL16438044 0.83 METAP2 (0.60) METAP2FFAR4KMT2AMAPTMEN1
SCHEMBL12840705 0.83 GAA (0.69) METAP2FFAR4KMT2AMAPTMEN1
SCHEMBL10891615 0.83 ALDH1A1 (0.67) FFAR4KMT2AMEN1ALDH1A1LMNA
SCHEMBL18757864 0.83 KEAP1 (0.56) FFAR4KMT2AMAPTALDH1A1POLB
SCHEMBL11593888 0.83 KMT2A (0.57) KMT2AMAPTMEN1ALDH1A1POLB
SCHEMBL2616417 0.82 METAP2 (0.62) METAP2FFAR4MAPTALDH1A1CYP2C9
SCHEMBL29402285 0.82 ALDH1A1 (0.69) METAP2FFAR4KMT2AMAPTMEN1

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-20120101097-A9 ARYL SULFONAMIDES UNGASHE SOLOMON (US) 2012-04-26 US disclosed
US-20110201610-A1 ARYL SULFONAMIDES UNGASHE SOLOMON 2011-08-18 US disclosed
US-7932252-B2 CCR9 chemokine receptor modulators; treating inflammatory and immune diseases; inhibit the binding of chemokines, such as TECK (thymus-expressed chemokine), to the CCR9 receptor; 1-arylsulfonamido-2-aryl(alkyl)benzene compounds CHEMOCENTRYX, INC. (US) 2011-04-26 US disclosed
US-20100234364-A1 CCR2 INHIBITORS AND METHODS OF USE THEREOF CHEMOCENTRYX, INC. 2010-09-16 US disclosed
US-20080161345-A1 Aryl Sulfonamides CHEMOCENTRYX, INC. 2008-07-03 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-20110201610-A1 ARYL SULFONAMIDES CCR2, CCL2, CX3CR1 METAP2 2202/4885FFAR4 220/4885KMT2A 2610/4885
US-20100234364-A1 CCR2 INHIBITORS AND METHODS OF USE THEREOF CCR2, CCR9, CCR1 METAP2 1506/4885FFAR4 362/4885KMT2A 2576/4885
US-20080161345-A1 Aryl Sulfonamides CCR2, CCL2, CX3CR1 METAP2 2202/4885FFAR4 220/4885KMT2A 2610/4885
US-20120101097-A9 ARYL SULFONAMIDES CCR2, CCL2, CX3CR1 METAP2 2202/4885FFAR4 220/4885KMT2A 2610/4885

“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.