SCHEMBL1848696

SCHEMBL1848696

O=C(O[C@](O)(C(=O)O)[C@](O)(OC(=O)c1ccccc1)C(=O)O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
F2 P00734 1/20 0.54
TSHR P16473 5/20 0.50
MAPK1 P28482 1/20 0.48
HIF1A Q16665 1/20 0.48
TDP1 Q9NUW8 4/20 0.47
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 1/20 0.47
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 3/20 0.44
MAPT P10636 3/20 0.44
POLB P06746 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
CES2 O00748 2/20 0.42
CES1 P23141 2/20 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
SCHEMBL1849951 1.00 LMNA (0.54) LMNAF2TSHRMAPK1HIF1A
SCHEMBL5818656 1.00 LMNA (0.54) LMNAF2TSHRMAPK1HIF1A
SCHEMBL7751600 0.92 LMNA (0.47) LMNAF2TSHRMAPK1HIF1A
SCHEMBL637757 0.88 TSHR (0.44) LMNAF2TSHRMAPK1HIF1A
SCHEMBL28706308 0.79 LMNA (0.61) LMNAF2TSHRMAPK1HIF1A
SCHEMBL28501745 0.78 LMNA (0.54) LMNAF2TSHRMAPK1HIF1A
SCHEMBL8945819 0.78 TSHR (0.57) LMNAF2TSHRMAPK1HIF1A
SCHEMBL28898522 0.77 LMNA (0.58) LMNAF2TSHRMAPK1HIF1A
SCHEMBL9888221 0.77 TDP1 (0.55) LMNAF2TSHRMAPK1HIF1A
SCHEMBL4737765 0.77 LMNA (0.52) LMNAF2TSHRMAPK1HIF1A

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-20110172427-A1 PROCESS FOR PREPARING CERTAIN CINNAMIDE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-07-14 US disclosed
EP-2324009-A1 PROCESS FOR PREPARING CERTAIN CINNAMIDE COMPOUNDS Eisai R&D Management Co., Ltd. (JP) 2011-05-25 EP disclosed
WO-2010025197-A1 PROCESS FOR PREPARING CERTAIN CINNAMIDE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-04 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 (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-20110172427-A1 PROCESS FOR PREPARING CERTAIN CINNAMIDE COMPOUNDS CYP4A11, CYP51A1, NISCH LMNA 1186/4885F2 2798/4885TSHR 4446/4885

“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.