SCHEMBL5650040

SCHEMBL5650040

COC(=O)c1ccc(C2(C)C(=O)N(Cc3ccc4ccc(C=NN)cc4c3)C(=O)N2Cc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 9/20 0.45
AGTR1 P30556 2/20 0.39
MDM2 Q00987 1/20 0.39
ENPP2 Q13822 1/20 0.39
ACP1 P24666 2/20 0.37
PTPN2 P17706 1/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA9 Q16790 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL5650573 0.93 TRPA1 (0.42) PTPN1AGTR1KMT2AHTTL3MBTL1
SCHEMBL5647820 0.92 PTPN1 (0.44) PTPN1ENPP2ACP1PTPN2KMT2A
SCHEMBL5645171 0.91 CTRB1 (0.40) PTPN1ACP1PTPN2KMT2AMEN1
SCHEMBL5649247 0.89 PTPN1 (0.44) PTPN1ACP1PTPN2KMT2AMEN1
SCHEMBL5648086 0.89 CTRB1 (0.40) PTPN1ACP1PTPN2KMT2AMEN1
SCHEMBL5647778 0.88 PTPN1 (0.46) PTPN1ACP1PTPN2KMT2AMEN1
SCHEMBL5646545 0.87 MEN1 (0.41) PTPN1ACP1PTPN2KMT2AMEN1
SCHEMBL5648228 0.86 PTPN1 (0.40) PTPN1ENPP2ACP1PTPN2KMT2A
SCHEMBL5648162 0.86 KMT2A (0.41) PTPN1ACP1PTPN2KMT2A
SCHEMBL5652364 0.85 CTRB1 (0.39) PTPN1ACP1PTPN2KMT2AMEN1

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 1843/4885AGTR1 39/4885MDM2 4803/4885
US-20060142363-A1 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SERPINC1, F2, BDKRB1 PTPN1 1936/4885AGTR1 49/4885MDM2 4740/4885

“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.