SCHEMBL695747

SCHEMBL695747

N#Cc1ccc(Sc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 3/20 0.57
PDE7A Q13946 11/20 0.52
PDE7B Q9NP56 4/20 0.52
PDE4B Q07343 1/20 0.50
PDE4D Q08499 1/20 0.50
TXNRD1 Q16881 1/20 0.43
TXNRD3 Q86VQ6 1/20 0.43
TXNRD2 Q9NNW7 1/20 0.43
PLA2G4A P47712 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MERTK Q12866 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL3103805 0.94 VCAM1 (0.51) VCAM1PDE7APDE7BPDE4BPDE4D
SCHEMBL2018745 0.83 PDE7A (0.62) VCAM1PDE7APDE7BPDE4BPDE4D
SCHEMBL694430 0.81 VCAM1 (0.62) VCAM1PDE7APDE7BPDE4BPDE4D
SCHEMBL4255731 0.81 MAPT (0.60) VCAM1PDE7APDE7BPDE4BPDE4D
SCHEMBL6519015 0.79 VCAM1 (0.62) VCAM1TXNRD1TXNRD3TXNRD2TDP1
SCHEMBL695567 0.75 SLC6A2 (0.47) PDE7AL3MBTL1
SCHEMBL6463 0.74 VCAM1 (1.00) VCAM1TDP1MERTK
SCHEMBL12253372 0.74 VCAM1 (1.00) VCAM1TDP1MERTK
SCHEMBL694090 0.73 TRPV4 (0.44) VCAM1
SCHEMBL694367 0.73 VCAM1 (0.48) VCAM1TXNRD1TXNRD3TXNRD2TDP1

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2749554-B1 2,5-disubstituted arylsulfonamide CCR3 antagonists SMA THERAPEUTICS INC (US) 2017-12-20 EP disclosed
EP-2749554-B1 2,5-disubstituted arylsulfonamide CCR3 antagonists SMA THERAPEUTICS INC (US) 2017-12-20 EP disclosed
US-20160031841-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. 2016-02-04 US disclosed
US-20160031841-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. 2016-02-04 US disclosed
US-20160031841-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. 2016-02-04 US disclosed
US-9187425-B2 2,5-disubstituted arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2015-11-17 US disclosed
US-9187425-B2 2,5-disubstituted arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2015-11-17 US disclosed
US-9187425-B2 2,5-disubstituted arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2015-11-17 US disclosed
CN-102459177-B The dibasic Arylsulfonamide ccr 3 antagonists of 2,5- AXIKIN PHARMACEUTICALS, INC. (US) 2015-09-02 CN disclosed
EP-2749554-A2 2,5-disubstituted arylsulfonamide CCR3 antagonists Axikin Pharmaceuticals, Inc. (US) 2014-07-02 EP disclosed
US-8318747-B2 2,5-disubstituted arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2012-11-27 US disclosed
US-8318747-B2 2,5-disubstituted arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2012-11-27 US disclosed
US-8318747-B2 2,5-disubstituted arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2012-11-27 US disclosed
CN-102459177-A 2,5-disubstituted arylsulfonamide ccr3 antagonists AXIKIN PHARMACEUTICALS INC 2012-05-16 CN disclosed
EP-2421830-A2 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS Axikin Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed
WO-2010123959-A2 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. (US) 2010-10-28 WO disclosed
WO-2010123959-A2 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. (US) 2010-10-28 WO disclosed
US-20100273785-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. 2010-10-28 US disclosed
US-20100273785-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. 2010-10-28 US disclosed
US-20100273785-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. 2010-10-28 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 (2 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-20160031841-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 VCAM1 1448/4885PDE7A 2273/4885PDE7B 1301/4885
US-20100273785-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 VCAM1 2012/4885PDE7A 2839/4885PDE7B 2121/4885

“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.