SCHEMBL5652582

SCHEMBL5652582

N=C(N)c1ccc2ccc(CN3C(=O)NC(c4ccccc4)(c4ccc(C(=O)O)cc4)C3=O)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
CNR1 P21554 1/20 0.47
HDAC6 Q9UBN7 3/20 0.46
POLB P06746 2/20 0.43
PLAU P00749 2/20 0.42
KMT2A Q03164 1/20 0.40
F2 P00734 1/20 0.39
F10 P00742 1/20 0.39
PRSS1 P07477 1/20 0.39
HRH1 P35367 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL5649898 0.95 TDP1 (0.50) TDP1CNR1HDAC6POLBPLAU
SCHEMBL5648643 0.94 TDP1 (0.47) TDP1CNR1HDAC6POLBPLAU
SCHEMBL5647162 0.94 TDP1 (0.48) TDP1CNR1HDAC6POLBPLAU
SCHEMBL5647687 0.92 CNR1 (0.47) TDP1CNR1HDAC6POLBPLAU
SCHEMBL5647390 0.90 TDP1 (0.47) TDP1CNR1HDAC6POLBPLAU
SCHEMBL5645719 0.90 KMT2A (0.46) TDP1CNR1HDAC6POLBKMT2A
SCHEMBL5647842 0.86 HDAC6 (0.44) TDP1HDAC6POLBKMT2AF2
SCHEMBL5652588 0.83 PTPN1 (0.44) TDP1CNR1HDAC6POLBKMT2A
SCHEMBL5647534 0.83 HDAC6 (0.58) HDAC6PLAUKMT2AF2F10
SCHEMBL5649043 0.81 HDAC6 (0.61) TDP1HDAC6PLAUF2F10

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 TDP1 1348/4885CNR1 247/4885HDAC6 172/4885
US-20060142363-A1 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SERPINC1, F2, BDKRB1 TDP1 1027/4885CNR1 639/4885HDAC6 501/4885

“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.