SCHEMBL2452424

SCHEMBL2452424

CC(C)c1cc(CNC(N)=S)on1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.52
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
ATM Q13315 1/20 0.43
LMNA P02545 3/20 0.42
SLC5A7 Q9GZV3 9/20 0.41
ALDH1A1 P00352 2/20 0.40
LIPC P11150 1/20 0.40
LIPG Q9Y5X9 1/20 0.40

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
SCHEMBL18884429 0.78 EPHX2 (0.48) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL12852537 0.76 EPHX2 (0.49) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL15470638 0.76 EPHX2 (0.56) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL10864502 0.73 EPHX2 (0.44) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL6404881 0.73 SLC5A7 (0.59) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL3862171 0.73 EPHX2 (0.53) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL442507 0.72 NOTUM (0.43) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL2306096 0.72 LMNA (0.45) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL6403886 0.72 SLC5A7 (0.53) EPHX2RAB9ANPC1SMN1; SMN2ATM
SCHEMBL6408017 0.71 SMN1; SMN2 (0.53) EPHX2RAB9ANPC1SMN1; SMN2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010535-B1 THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO ASTRAZENECA AB (SE) 2012-07-11 EP disclosed
US-8026244-B2 Thioxanthine derivatives and their use as inhibitors of MPO ASTRAZENECA AB (SE) 2011-09-27 US disclosed
US-20090149475-A1 Thioxanthine Derivatives and Their Use as Inhibitors of MPO ASTRAZENECA AB (SE) 2009-06-11 US disclosed
EP-2010535-A1 THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO AstraZeneca AB (SE) 2009-01-07 EP disclosed
WO-2007120098-A1 THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO ASTRAZENECA AB (SE) 2007-10-25 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-20090149475-A1 Thioxanthine Derivatives and Their Use as Inhibitors of MPO MPO, XDH, EPX EPHX2 811/4885RAB9A 3193/4885NPC1 2838/4885

“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.