SCHEMBL5647771

SCHEMBL5647771

COC(=O)COc1ccc(C2(C)C(=O)N(Cc3ccc4ccc(C(=N)N)cc4c3)C(=O)N2Cc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.44
F10 P00742 9/20 0.43
F2 P00734 7/20 0.43
PRSS1 P07477 6/20 0.43
PLAU P00749 2/20 0.38
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
OPRL1 P41146 1/20 0.36
MRGPRX1 Q96LB2 1/20 0.35
AMPD2 Q01433 1/20 0.35
HDAC6 Q9UBN7 2/20 0.35

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
SCHEMBL5646533 0.93 F10 (0.45) F10F2PRSS1PLAUAMPD2
SCHEMBL5650033 0.89 PTPN1 (0.40) PTPN1F10F2PRSS1PLAU
SCHEMBL5645162 0.87 PLAU (0.42) F10F2PRSS1PLAUHDAC6
SCHEMBL5647814 0.87 FNTA (0.44) PTPN1F10F2PRSS1PLAU
SCHEMBL5645835 0.87 PLAU (0.45) F10F2PRSS1PLAUHDAC6
SCHEMBL5650716 0.86 PLAU (0.45) F10F2PRSS1PLAUHDAC6
SCHEMBL5647175 0.85 PLAU (0.42) F10F2PRSS1PLAU
SCHEMBL5647812 0.85 PLAU (0.42) F10F2PRSS1PLAUHDAC6
SCHEMBL5647778 0.85 PTPN1 (0.46) PTPN1OPRL1
SCHEMBL5648073 0.84 CTRB1 (0.41) F10F2PRSS1PLAUHDAC6

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-7199146-B2 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SCHERING AKTIENGESELLSCHAFT (DE) 2007-04-03 US disclosed
US-20060142363-A1 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SCHERING AKTIENGESELLSCHAFT (DE) 2006-06-29 US disclosed
US-7053112-B2 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SCHERING AKTIENGESELLSCHAFT (DE) 2006-05-30 US disclosed
US-20040122073-A1 Imidazolidinedione analogs useful as anticoagulants and antihrombotics SCHERING AKTIENGESELLSCHAFT (DE) 2004-06-24 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 (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-20040122073-A1 Imidazolidinedione analogs useful as anticoagulants and antihrombotics SERPINC1, F2, BDKRB1 PTPN1 1843/4885F10 10/4885F2 2/4885
US-20060142363-A1 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SERPINC1, F2, BDKRB1 PTPN1 1936/4885F10 15/4885F2 2/4885

“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.