SCHEMBL5673166

SCHEMBL5673166

CCCCC(Oc1ccc(C(=O)OC)cc1C=O)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERAP2 Q6P179 2/20 0.39
LNPEP Q9UIQ6 2/20 0.39
ERN1 O75460 5/20 0.38
MGLL Q99685 3/20 0.38
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
NPC1 O15118 1/20 0.35
CASP1 P29466 1/20 0.35
RAB9A P51151 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CTSK P43235 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL5223661 0.86 ERAP2 (0.45) ERAP2LNPEPERN1MGLLALDH1A1
SCHEMBL2329831 0.76 ALDH1A1 (0.44) ERN1ALDH1A1KDM4EL3MBTL1TAS1R3
SCHEMBL5671783 0.74 MGLL (0.37) MGLLALDH1A1KDM4EHPGDTAS1R3
SCHEMBL14634320 0.73 RORC (0.40) ALDH1A1HPGDTAS1R3TAS1R1TSHR
SCHEMBL2593180 0.73 ERN1 (0.48) ERN1ALDH1A1KDM4EHPGDCASP1
SCHEMBL6459702 0.73 PTGDR2 (0.41) ERN1ALDH1A1KDM4EHPGDTSHR
SCHEMBL6459325 0.72 ALDH1A1 (0.42) ERN1ALDH1A1MAPT
SCHEMBL31405377 0.72 ERN1 (0.47) ERN1ALDH1A1KDM4EL3MBTL1HCRTR1
SCHEMBL14634986 0.71 PTGDR2 (0.46) ERN1ALDH1A1HPGDTSHRMAPK1
SCHEMBL10068764 0.70 CREBBP (0.50) ERN1ALDH1A1KDM4EL3MBTL1NPC1

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-7148240-B2 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same SANOFI-AVENTIS (FR) 2006-12-12 US disclosed
US-20040010011-A1 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same SANOFI (FR) 2004-01-15 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-20040010011-A1 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same ABAT, TNNT2, BCAT1 ERAP2 733/4885LNPEP 1546/4885ERN1 3846/4885

“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.