SCHEMBL4881258

SCHEMBL4881258

Cc1nc2cc(NS(=O)(=O)c3ccc(Cl)cc3Cl)ccc2o1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 9/20 0.55
PTPN1 P18031 9/20 0.55
PTPN5 P54829 8/20 0.55
ACLY P53396 1/20 0.54
FBP1 P09467 4/20 0.53
HSPD1 P10809 1/20 0.51
HSPE1 P61604 1/20 0.51
EDNRA P25101 2/20 0.49
ITGA1 P56199 1/20 0.49
PPARG P37231 2/20 0.48
BRD4 O60885 1/20 0.47
CYP3A4 P08684 1/20 0.47
EDNRB P24530 1/20 0.47

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
SCHEMBL4883514 0.91 FBP1 (0.53) FBP1EDNRAITGA1PPARGCYP3A4
SCHEMBL616005 0.91 FBP1 (0.65) PTPN2PTPN1PTPN5ACLYFBP1
SCHEMBL27422029 0.83 MEN1 (0.56) PTPN2PTPN1PTPN5ACLYFBP1
SCHEMBL618236 0.82 PTPN1 (0.59) PTPN2PTPN1PTPN5ACLYHSPD1
SCHEMBL617755 0.81 FBP1 (0.65) FBP1EDNRAEDNRB
SCHEMBL8859238 0.76 RAB9A (0.56) PTPN2PTPN1PTPN5HSPD1HSPE1
SCHEMBL4875632 0.76 LMNA (0.64) ITGA1PPARG
SCHEMBL28614348 0.76 BRD4 (0.73) PTPN2PTPN1PTPN5HSPD1HSPE1
SCHEMBL618899 0.75 NPC1 (0.54) EDNRAITGA1PPARGCYP3A4
Iodide SCHEMBL10395553 0.75 RAB9A (0.55) PTPN2PTPN1PTPN5HSPD1HSPE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255169-A1 4'-Fluoro-biphenyl-3-sulfonic acid benzo[1,3]dioxol-5-ylamide, for example; for use as an alpha 2 beta 1 integrin I domain inhibitor; use as a medicament for treating thrombosis and cancer spread BIOTIE THERAPIES CORPORATION (FI) 2008-10-16 US disclosed
EP-1732884-A1 SULPHONAMIDE DERIVATIVES Biotie Therapies Corp. (FI) 2006-12-20 EP disclosed
WO-2005090298-A1 SULPHONAMIDE DERIVATIVES BIOTIE THERAPIES CORPORATION (FI) 2005-09-29 WO disclosed
WO-2005090297-A1 SULPHONAMIDE DERIVATIVES BIOTIE THERAPIES CORPORATION (FI) 2005-09-29 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-20080255169-A1 4'-Fluoro-biphenyl-3-sulfonic acid benzo[1,3]dioxol-5-ylamide, for example; for use as an alpha 2 beta 1 integrin I domain inhibitor; use as a medicament for treating thrombosis and cancer spread NR1I2, ITGA2, ITGB2 PTPN2 1095/4885PTPN1 1619/4885PTPN5 1697/4885

“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.