SCHEMBL4892640

SCHEMBL4892640

CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc3cc[nH]c3c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 13/20 0.53
F13A1 P00488 10/20 0.53
TGM1 P22735 7/20 0.53
PKM P14618 1/20 0.46
NUDT15 Q9NV35 1/20 0.46
TGM3 Q08188 1/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
MAPT P10636 1/20 0.45
STS P08842 1/20 0.45

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
SCHEMBL5327420 0.84 TGM2 (0.52) TGM2F13A1TGM1LMNA
SCHEMBL6790392 0.82 PKM (0.65) TGM2F13A1TGM1PKMLMNA
SCHEMBL5202414 0.81 STS (0.57) TGM2F13A1TGM1TGM3MAPT
SCHEMBL5736659 0.81 F10 (0.57) TGM2F13A1TGM1PKM
SCHEMBL3210642 0.80 TGM2 (0.59) TGM2F13A1TGM1TGM3STS
SCHEMBL3044686 0.79 GHSR (0.60)
SCHEMBL29979105 0.79 MAPT (0.54) LMNAHTTMAPT
SCHEMBL1226103 0.79 MAPT (0.54) LMNAHTTMAPT
SCHEMBL2822894 0.78 TGM2 (0.43) TGM2F13A1TGM1TGM3MAPT
SCHEMBL18410584 0.78 TGM2 (0.65) TGM2F13A1TGM1PKMHTT

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-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa ASTRAZENECA AB (SE) 2008-09-04 US disclosed
US-20080200431-A1 6-{4-[4-(3-Chloro-1H-indole-6-sulfonyl)-3-hydroxy-piperazine-1-carbonyl]-piperidin-1-yl}-2-methyl-2H-pyridazin-3-one for example; antithrombotic and anticoagulant; synthesis; combination therapy ASTRAZENECA AB (SE) 2008-08-21 US disclosed
WO-2007008146-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 WO disclosed
WO-2007008143-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 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 (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-20080200431-A1 6-{4-[4-(3-Chloro-1H-indole-6-sulfonyl)-3-hydroxy-piperazine-1-carbonyl]-piperidin-1-yl}-2-methyl-2H-pyridazin-3-one for example; antithrombotic and anticoagulant; synthesis; combination therapy CYC1, F2, CBR1 TGM2 4220/4885F13A1 191/4885TGM1 2092/4885
US-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa F10, F12, F11 TGM2 4127/4885F13A1 16/4885TGM1 1690/4885

“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.