SCHEMBL4650569

SCHEMBL4650569

N#Cc1ccc(NS(=O)(=O)c2ccc(Cl)cc2Cl)cc1Cl

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 9/20 0.73
▸ PPARG P37231 4/20 0.62
▸ CYP3A4 P08684 2/20 0.62
▸ ITGA1 P56199 4/20 0.55
▸ MEN1 O00255 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ ALOX12 P18054 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ NLRP1 Q9C000 1/20 0.53
▸ CDK1 P06493 1/20 0.50
▸ CCNB1 P14635 1/20 0.50
▸ CCNA2 P20248 1/20 0.50
▸ CDK2 P24941 1/20 0.50
▸ CDK7 P50613 1/20 0.50
▸ CCNH P51946 1/20 0.50
▸ CCNA1 P78396 1/20 0.50
▸ HDAC1 Q13547 1/20 0.49
▸ HDAC8 Q9BY41 1/20 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
SCHEMBL4649546 0.83 SLC22A12 (0.63) SLC22A12PPARGCYP3A4ITGA1MEN1
SCHEMBL20355144 0.80 SLC22A12 (0.58) SLC22A12PPARGCYP3A4CDK1CCNB1
SCHEMBL12584590 0.78 PPARG (1.00) SLC22A12PPARGCYP3A4
SCHEMBL2029062 0.76 ITGA1 (0.68) PPARGITGA1MEN1LMNAMAPT
SCHEMBL2678340 0.76 SLC22A12 (0.62) SLC22A12
SCHEMBL3268657 0.76 MAPT (0.61) PPARGCYP3A4ITGA1MEN1LMNA
SCHEMBL16325537 0.75 CDK1 (0.65) PPARGITGA1MEN1LMNAMAPT
SCHEMBL14018772 0.75 MAPT (0.63) PPARGCYP3A4ITGA1MEN1LMNA
SCHEMBL94831 0.75 MAPT (0.63) PPARGCYP3A4ITGA1MEN1LMNA
SCHEMBL28121241 0.75 MAPT (0.63) PPARGITGA1MEN1LMNAMAPT

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-20080275114-A1 Inhibitors of Ccr9 Activity NOVARTIS AG (CH) 2008-11-06 — — US claimed
EP-1966131-A1 INHIBITORS OF CCR9 ACTIVITY Novartis Pharma AG (CH) 2008-09-10 — — EP claimed
WO-2007071443-A1 INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2007-06-28 — — WO claimed
US-20080275114-A1 Inhibitors of Ccr9 Activity NOVARTIS AG (CH) 2008-11-06 — — US disclosed
EP-1966131-A1 INHIBITORS OF CCR9 ACTIVITY Novartis Pharma AG (CH) 2008-09-10 — — EP disclosed
WO-2007071443-A1 INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2007-06-28 — — 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 (1 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-20080275114-A1 Inhibitors of Ccr9 Activity CCR9, CCR1, CCR4 SLC22A12 2675/4885PPARG 3824/4885CYP3A4 896/4885

“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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