SCHEMBL5651384

SCHEMBL5651384

CC1(c2ccccc2)C(=O)N(Cc2ccc3ccc(C=NN)cc3c2)C(=O)N1CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.37
KMT2A Q03164 3/20 0.36
PTPN1 P18031 3/20 0.35
ACP1 P24666 3/20 0.35
HDAC6 Q9UBN7 2/20 0.33
CTRB1 P17538 1/20 0.33
PTPN2 P17706 1/20 0.33
OPRL1 P41146 1/20 0.32
GRM2 Q14416 2/20 0.32
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL5645241 0.94 KMT2A (0.36) AKR1B1KMT2APTPN1ACP1HDAC6
SCHEMBL5646331 0.91 PTPN1 (0.34) AKR1B1KMT2APTPN1ACP1HDAC6
SCHEMBL5653212 0.90 CYP1A2 (0.34) AKR1B1KMT2APTPN1ACP1HDAC6
SCHEMBL5647961 0.89 HTR1A (0.33) AKR1B1KMT2APTPN1ACP1HDAC6
SCHEMBL5647793 0.89 OPRM1 (0.34) KMT2APTPN1ACP1HDAC6CTRB1
SCHEMBL5649247 0.89 PTPN1 (0.44) KMT2APTPN1ACP1HDAC6CTRB1
SCHEMBL5650645 0.88 HTR1A (0.35) KMT2APTPN1ACP1MEN1CYP3A4
SCHEMBL5646512 0.88 HTR1A (0.35) KMT2APTPN1ACP1MEN1CYP3A4
SCHEMBL5650011 0.88 PTPN1 (0.33) KMT2APTPN1ACP1HDAC6CTRB1
SCHEMBL5648086 0.88 CTRB1 (0.40) KMT2APTPN1ACP1HDAC6CTRB1

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 AKR1B1 914/4885KMT2A 3162/4885PTPN1 1843/4885
US-20060142363-A1 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SERPINC1, F2, BDKRB1 AKR1B1 627/4885KMT2A 3939/4885PTPN1 1936/4885

“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.