SCHEMBL6098666

SCHEMBL6098666

COC(=O)CCCN1C(=O)N(Cc2ccc3ccc(C=NN)cc3c2)C(=O)C1(C)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.35
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
KMT2A Q03164 1/20 0.34
PTPN1 P18031 4/20 0.33
ACP1 P24666 2/20 0.33
PTPN2 P17706 1/20 0.33
AGTR1 P30556 1/20 0.32
TYR P14679 1/20 0.32
OPRM1 P35372 1/20 0.32
CASP3 P42574 1/20 0.32
HDAC6 Q9UBN7 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTR1A P08908 2/20 0.31
HTR7 P34969 2/20 0.31
HTR6 P50406 2/20 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
SCHEMBL5650375 0.98 OPRL1 (0.35) OPRL1MEN1CYP3A4CYP2D6CYP2C9
SCHEMBL5646880 0.93 GRM4 (0.37) KMT2APTPN1ALDH1A1
SCHEMBL5653212 0.92 CYP1A2 (0.34) MEN1KMT2APTPN1ACP1PTPN2
SCHEMBL5650011 0.92 PTPN1 (0.33) MEN1KMT2APTPN1ACP1PTPN2
SCHEMBL5647474 0.91 GRM4 (0.35) KMT2APTPN1HTR1AHTR6
SCHEMBL5650137 0.90 GRM4 (0.34) KMT2APTPN1HTR1AHTR6
SCHEMBL5647983 0.90 GRM4 (0.34) KMT2APTPN1HTR1AHTR6
SCHEMBL5647961 0.90 HTR1A (0.33) MEN1CYP3A4CYP2D6CYP2C9KMT2A
SCHEMBL5650645 0.89 HTR1A (0.35) MEN1CYP3A4CYP2D6CYP2C9KMT2A
SCHEMBL5648950 0.89 HTR1A (0.35) PTPN1ACP1HDAC6HTR1AHTR7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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 OPRL1 3903/4885MEN1 795/4885CYP3A4 167/4885

“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.