SCHEMBL4878237

SCHEMBL4878237

Cc1cc(C)nc(N(C)c2ccc(N(S(=O)(=O)c3ccc(Cl)cc3Cl)S(=O)(=O)c3ccc(Cl)cc3Cl)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 3/20 0.43
GAA P10253 1/20 0.40
PCTP Q9UKL6 2/20 0.40
STARD10 Q9Y365 2/20 0.40
HSD11B1 P28845 1/20 0.39
TRPV4 Q9HBA0 1/20 0.38
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 1/20 0.35
EDNRA P25101 2/20 0.35
HTT P42858 1/20 0.34
HPGD P15428 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
EDNRB P24530 1/20 0.34

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
SCHEMBL14018589 0.90 SMN1; SMN2 (0.48) SMN1; SMN2KDM4EGAAPCTPSTARD10
SCHEMBL4875554 0.82 MAPT (0.54) ALDH1A1MAPTKMT2ALMNAEDNRA
SCHEMBL4882733 0.79 MAPT (0.51) PCTPSTARD10ALDH1A1MAPTKMT2A
SCHEMBL715497 0.79 MAPT (0.42) SMN1; SMN2KDM4EGAAHSD11B1ALDH1A1
SCHEMBL4884325 0.71 CA1 (0.51) GAAALDH1A1MAPTKMT2ALMNA
SCHEMBL14018770 0.71 CDK1 (0.47) ALDH1A1MAPTKMT2ALMNAEDNRA
SCHEMBL4879959 0.68 KDM4E (0.59) SMN1; SMN2KDM4EHSD11B1TRPV4ALDH1A1
SCHEMBL4175248 0.66 KDM4E (0.56) KDM4EHSD11B1TRPV4ALDH1A1MAPT
SCHEMBL13990896 0.66 NPC1 (0.47) SMN1; SMN2ALDH1A1MAPTLMNAHTT
SCHEMBL13990752 0.66 SMN1; SMN2 (0.39) SMN1; SMN2KDM4EGAAALDH1A1MAPT

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 SMN1; SMN2 4203/4885KDM4E 1548/4885GAA 4655/4885

“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.