SCHEMBL4939620

SCHEMBL4939620

Cn1nc(N2CCC(C(=O)N3CCN(S(=O)(=O)c4cc5cc(Cl)ccc5[nH]4)C(O)C3)CC2)ccc1=O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.40
F10 P00742 16/20 0.40
KLK1 P06870 1/20 0.40
HRH4 Q9H3N8 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL4936118 0.88 F10 (0.49) F10KLK1USP2LMNATSHR
SCHEMBL4938175 0.87 USP2 (0.49) F10KLK1USP2LMNATSHR
SCHEMBL5334159 0.85 F10 (0.47) F10KLK1USP2LMNATSHR
SCHEMBL4936160 0.80 F10 (0.37) HRH3F10USP2LMNATSHR
SCHEMBL4890727 0.78 HRH3 (0.40) HRH3F10USP2LMNATSHR
SCHEMBL4942713 0.76 NPSR1 (0.47) F10KLK1USP2LMNATSHR
SCHEMBL4941429 0.75 F10 (0.66) F10USP2LMNATSHRHTT
SCHEMBL4938153 0.74 SMO (0.49) F10KLK1USP2TSHRHTT
SCHEMBL4936184 0.74 F10 (0.48) F10KLK1
SCHEMBL5398205 0.74 F10 (0.48) F10KLK1

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 claimed
WO-2007008143-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 WO claimed
US-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa ASTRAZENECA AB (SE) 2008-09-04 US 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 (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 HRH3 31/4885F10 1/4885KLK1 2546/4885

“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.