SCHEMBL4599154

SCHEMBL4599154

NCCCC[C@H](NC(=O)C(N)Cc1cccc2ccccc12)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.51
HRH4 Q9H3N8 1/20 0.50
MME P08473 1/20 0.49
ACE P12821 1/20 0.49
CPA1 P15085 1/20 0.49
ACE2 Q9BYF1 1/20 0.49
ERAP2 Q6P179 2/20 0.48
LNPEP Q9UIQ6 2/20 0.48
REN P00797 1/20 0.47
TGM2 P21980 1/20 0.47
ERAP1 Q9NZ08 1/20 0.46
NTMT1 Q9BV86 1/20 0.44
OPRD1 P41143 1/20 0.44
CASR P41180 1/20 0.44
CTNNB1 P35222 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43

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
SCHEMBL4599159 1.00 FOLH1 (0.51) FOLH1HRH4MMEACECPA1
SCHEMBL30477359 0.86 FOLH1 (0.58) FOLH1HRH4MMEACECPA1
SCHEMBL22129751 0.83 FOLH1 (0.55) FOLH1MMEACECPA1ACE2
SCHEMBL22129752 0.83 FOLH1 (0.55) FOLH1MMEACECPA1ACE2
SCHEMBL29511126 0.83 HRH4 (0.63) HRH4MMEACECPA1ACE2
SCHEMBL28540087 0.83 ERAP2 (0.65) ERAP2LNPEPERAP1MMP2
SCHEMBL170652 0.83 ERAP2 (0.65) ERAP2LNPEPERAP1MMP2
SCHEMBL29382413 0.83 ERAP2 (0.65) ERAP2LNPEPERAP1MMP2
SCHEMBL29372662 0.83 ERAP2 (0.65) ERAP2LNPEPERAP1MMP2
SCHEMBL1711485 0.83 ERAP2 (0.65) ERAP2LNPEPERAP1MMP2

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-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-17 US disclosed
EP-1910279-A2 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2008-04-16 EP disclosed
US-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-25 US disclosed
WO-2007002639-A2 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-04 WO 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-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF HAVCR2, ADAR, NSUN2 FOLH1 771/4885HRH4 2570/4885MME 484/4885
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE POLQ, POLI, POLH FOLH1 1486/4885HRH4 4095/4885MME 1824/4885

“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.