SCHEMBL6504149

SCHEMBL6504149

Nc1cccc(-c2c(CC(=O)O)nc(NC3CCC3)c(=O)n2Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F7 P08709 19/20 0.56
F2 P00734 6/20 0.56
F10 P00742 2/20 0.56
PRSS1 P07477 11/20 0.55
PRSS2 P07478 10/20 0.55
PRSS3 P35030 10/20 0.55
F3 P13726 5/20 0.54

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
SCHEMBL5846492 0.79 F7 (0.78) F7F2F10PRSS1PRSS2
SCHEMBL5847389 0.63 ABCG2 (0.41) F7F2F10PRSS1PRSS2
SCHEMBL22939441 0.60 MAPT (0.64)
SCHEMBL24661857 0.58 KDM4E (0.48)
SCHEMBL24864099 0.56 AURKA (0.61)
SCHEMBL28034992 0.56 CFTR (0.53)
SCHEMBL20255560 0.56 SHMT2 (0.66)
SCHEMBL11629386 0.56 EPHX2 (0.68)
SCHEMBL17241734 0.56 SYK (0.47)
SCHEMBL15928723 0.56 KDM4E (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050043313-A1 Substituted polycyclic aryl and heteroaryl pyrazinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2005-02-24 US disclosed
EP-1292579-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRAZINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE Pharmacia Corporation (US) 2003-03-19 EP disclosed
WO-2001087854-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRAZINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2001-11-22 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-20050043313-A1 Substituted polycyclic aryl and heteroaryl pyrazinones useful for selective inhibition of the coagulation cascade TFPI, TFPI2, PLAT F7 62/4885F2 6/4885F10 48/4885

“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.