SCHEMBL5872248

SCHEMBL5872248

CCCCCOC(=O)C(Cc1[c]cc(CC(C(=O)OCCCCC)C(=O)OCCCCC)cc1)C(=O)OCCCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.38
EPHX1 P07099 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CSNK2A2 P19784 1/20 0.36
CSNK2A1 P68400 1/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PPARG P37231 3/20 0.36

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
SCHEMBL5871964 0.81 TSHR (0.39) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL5871869 0.80 NAAA (0.41) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL5872165 0.78 TSHR (0.41) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL5871820 0.78 TSHR (0.44) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL5871865 0.78 TSHR (0.47) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL5871978 0.77 ALDH1A1 (0.45) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL28054295 0.77 TSHR (0.55) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL14680117 0.77 TSHR (0.55) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL14680133 0.77 TSHR (0.55) TSHRTP53CYP3A4MAPK1ALDH1A1
SCHEMBL5871668 0.74 TSHR (0.42) TSHRTP53CYP3A4MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7071187-B2 Naphthyridine derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2006-07-04 US disclosed
US-20040214853-A1 Naphthyridine derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2004-10-28 US disclosed
EP-1426374-A1 NAPHTHYRIDINE DERIVATIVE OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2004-06-09 EP 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-20040214853-A1 Naphthyridine derivatives MT-ND1, OPRD1, NR0B1 TSHR 2365/4885TP53 4064/4885CYP3A4 858/4885

“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.