SCHEMBL4936809

SCHEMBL4936809

C/C=C(/c1ccc(Cl)s1)S(=O)(=O)N1CCN(CC2CCN(c3ccc(=O)[nH]n3)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.37
HRH3 Q9Y5N1 3/20 0.35
PARP1 P09874 2/20 0.35
SMO Q99835 1/20 0.33
F10 P00742 3/20 0.32
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MELK Q14680 1/20 0.31
KDM2B Q8NHM5 1/20 0.30

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
SCHEMBL4941338 0.85 SMO (0.47) EPHX2HRH3SMOF10LMNA
SCHEMBL4941341 0.70 SMO (0.47) HRH3SMOF10SMN1; SMN2
SCHEMBL4941337 0.70 SMO (0.47) HRH3SMOF10SMN1; SMN2
SCHEMBL9214671 0.65 HRH3 (0.46) EPHX2HRH3SMO
SCHEMBL9219478 0.63 HRH3 (0.47) HRH3SMO
SCHEMBL9220710 0.63 HRH3 (0.45) EPHX2HRH3SMO
SCHEMBL21626550 0.63 HRH3 (0.52) HRH3SMOLMNASMN1; SMN2
SCHEMBL15548336 0.63 HRH3 (0.54) EPHX2HRH3SMOLMNA
SCHEMBL4890873 0.60 LMNA (0.55) HRH3SMOLMNA
SCHEMBL31514107 0.58 HRH3 (0.48) EPHX2HRH3MAPK1SMN1; SMN2

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 1 patent. 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

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-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa F10, F12, F11 EPHX2 1143/4885HRH3 31/4885PARP1 1069/4885

“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.