SCHEMBL4598877

SCHEMBL4598877

NCCCCC(NC(=O)CNCc1ccc(F)cc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 9/20 0.57
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
SLC6A5 Q9Y345 1/20 0.43
TLR2 O60603 2/20 0.43
CPB2 Q96IY4 1/20 0.42
TGM2 P21980 1/20 0.42
CYP2D6 P10635 1/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL4598870 1.00 FOLH1 (0.57) FOLH1ALDH1A1LMNASLC6A5TLR2
SCHEMBL4600358 0.88 FOLH1 (0.57) FOLH1ALDH1A1LMNASLC6A5CPB2
SCHEMBL4600730 0.88 SLC6A5 (0.46) FOLH1SLC6A5TLR2CPB2TGM2
SCHEMBL4600727 0.88 SLC6A5 (0.46) FOLH1SLC6A5TLR2CPB2TGM2
SCHEMBL4600366 0.88 FOLH1 (0.57) FOLH1ALDH1A1LMNASLC6A5CPB2
SCHEMBL4739886 0.87 FOLH1 (0.55) FOLH1SLC6A5
SCHEMBL4600558 0.87 TGM2 (0.45) FOLH1SLC6A5CPB2TGM2
SCHEMBL4600554 0.87 TGM2 (0.45) FOLH1SLC6A5CPB2TGM2
SCHEMBL4739889 0.87 FOLH1 (0.55) FOLH1SLC6A5
SCHEMBL4600264 0.85 CPB2 (0.56) ALDH1A1SLC6A5CPB2

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 5 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
WO-2008080223-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-10 WO 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 771/4885ALDH1A1 1732/4885LMNA 1358/4885
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE POLQ, POLI, POLH FOLH1 1486/4885ALDH1A1 2546/4885LMNA 786/4885

“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.