SCHEMBL1337152

SCHEMBL1337152

O=C(Nc1ccc(S(=O)(=O)Cl)c2ccccc12)c1c(F)cccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CCR8 P51685 3/20 0.40
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40
RORC P51449 1/20 0.40
KAT6A Q92794 1/20 0.40
SLC22A12 Q96S37 1/20 0.39
PLA2G7 Q13093 1/20 0.39
TP53 P04637 2/20 0.38
TYK2 P29597 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
TLR8 Q9NR97 1/20 0.38
STIM1 Q13586 1/20 0.38
ORAI1 Q96D31 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL1338744 0.89 TP53 (0.46) MEN1KMT2ACCR8TP53TYK2
SCHEMBL1339130 0.83 LMNA (0.48) KDM4EMEN1KMT2ACCR8TP53
SCHEMBL1338897 0.79 CCR8 (0.53) KDM4EMEN1KMT2ACCR8KAT6A
SCHEMBL1339592 0.79 CCR8 (0.65) CCR8
SCHEMBL21652252 0.75 SMN1; SMN2 (0.48) KDM4EMEN1KMT2AITGB1ITGA4
SCHEMBL6415098 0.74 CCR8 (0.42) CCR8
SCHEMBL1339758 0.74 CCR8 (0.75) CCR8
SCHEMBL1338666 0.73 CCR8 (0.68) CCR8TP53
SCHEMBL25872127 0.71 MAPT (0.52) MEN1KMT2AITGB1ITGA4TP53
SCHEMBL1855816 0.70 KMT2A (0.57) KDM4EMEN1KMT2ACCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063222-B2 Aryl sulfonamides useful as inhibitors of chemokine receptor activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-11-22 US disclosed
US-20090275556-A1 Aryl sulfonamides useful as inhibitors of chemokine receptor activity MILLENNIUM PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-7491827-B2 Aryl sulfonamides useful as inhibitors of chemokine receptor activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-02-17 US disclosed
US-7378525-B2 CCR8 inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-05-27 US disclosed
US-7329755-B2 especially naphthalene sulfonamides, used for treating asthma MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-02-12 US disclosed
EP-1590327-A1 CCR8 INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-11-02 EP disclosed
EP-1581511-A1 CCR8 INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-10-05 EP disclosed
US-20050085518-A1 Aryl sulfonamides useful as inhibitors of chemokine receptor activity MILLENNIUM PHARMACEUTICALS, INC. 2005-04-21 US disclosed
US-20040224978-A1 CCR8 inhibitors MILLENNIUM PHARMACEUTICALS, INC. 2004-11-11 US disclosed
US-20040209948-A1 CCR8 Inhibitors MILLENNIUM PHARMACEUTICALS, INC. 2004-10-21 US disclosed
WO-2004058709-A1 CCR8 INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2004-07-15 WO disclosed
WO-2004058736-A1 CCR8 INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2004-07-15 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 (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-20050085518-A1 Aryl sulfonamides useful as inhibitors of chemokine receptor activity CCR8, CCR1, CCR3 KDM4E 3720/4885MEN1 4774/4885KMT2A 2668/4885
US-20090275556-A1 Aryl sulfonamides useful as inhibitors of chemokine receptor activity CCR8, CCR1, CCR3 KDM4E 3818/4885MEN1 4759/4885KMT2A 2964/4885
US-20040209948-A1 CCR8 Inhibitors CCR8, CCR1, CCR3 KDM4E 4654/4885MEN1 4186/4885KMT2A 3975/4885
US-20040224978-A1 CCR8 inhibitors CCR8, CCR1, CCRL2 KDM4E 4812/4885MEN1 3701/4885KMT2A 4530/4885

“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.