SCHEMBL5471995

SCHEMBL5471995

CCn1cc(C(=O)OC(C)C)c(=O)c2cc(SCCNC(=O)OC(C)(C)C)ccc21

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPK1 P28482 1/20 0.39
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
TP53 P04637 2/20 0.37

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
SCHEMBL3816675 0.90 LMNA (0.55) LMNASMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL3983514 0.88 ALDH1A1 (0.51) LMNAALDH1A1HPGDKDM4ETSHR
SCHEMBL3983498 0.88 ALDH1A1 (0.51) LMNASMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL3983501 0.87 LMNA (0.42) LMNASMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL3811662 0.85 LMNA (0.52) LMNASMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL4396358 0.83 ALDH1A1 (0.48) LMNASMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL5469836 0.83 LMNA (0.49) LMNASMN1; SMN2ALDH1A1HPGDKDM4E
Formic Acid SCHEMBL4392627 0.83 LMNA (0.49) LMNASMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL3815910 0.81 LMNA (0.49) LMNAALDH1A1HPGDKDM4ETSHR
SCHEMBL27634843 0.80 IDO1 (0.35) LMNAALDH1A1HPGDKDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213283-A1 Macrolides substituted at the 4\"-position GLAXO GROUP LIMITED (GB) 2007-09-13 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-20070213283-A1 Macrolides substituted at the 4\"-position IL4, CYP51A1, IL17A LMNA 2144/4885SMN1; SMN2 1956/4885ALDH1A1 2288/4885

“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.