SCHEMBL5652588

SCHEMBL5652588

NN=Cc1ccc2ccc(CN3C(=O)NC(c4ccccc4)(c4ccc(C(=O)O)cc4)C3=O)cc2c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.44
ACP1 P24666 4/20 0.44
HDAC6 Q9UBN7 3/20 0.44
CNR1 P21554 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 2/20 0.40
PTPN2 P17706 2/20 0.39
KMT2A Q03164 1/20 0.38
HRH1 P35367 1/20 0.37
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL5648649 0.94 TDP1 (0.42) PTPN1ACP1HDAC6CNR1TDP1
SCHEMBL5647169 0.94 TDP1 (0.44) PTPN1ACP1HDAC6CNR1TDP1
SCHEMBL5645726 0.91 KMT2A (0.44) PTPN1HDAC6CNR1TDP1POLB
SCHEMBL5647399 0.89 TDP1 (0.43) HDAC6CNR1TDP1POLBKMT2A
SCHEMBL5647852 0.86 HDAC6 (0.41) HDAC6CNR1TDP1POLBKMT2A
SCHEMBL5652582 0.83 TDP1 (0.48) HDAC6CNR1TDP1POLBKMT2A
SCHEMBL5649247 0.80 PTPN1 (0.44) PTPN1ACP1HDAC6PTPN2KMT2A
SCHEMBL5647820 0.79 PTPN1 (0.44) PTPN1ACP1PTPN2KMT2A
SCHEMBL5649884 0.78 HDAC6 (0.46) HDAC6TDP1KMT2A
SCHEMBL5645672 0.78 HDAC6 (0.46) HDAC6TDP1KMT2A

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 1843/4885ACP1 1675/4885HDAC6 172/4885
US-20060142363-A1 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SERPINC1, F2, BDKRB1 PTPN1 1936/4885ACP1 2051/4885HDAC6 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.