SCHEMBL7797779

SCHEMBL7797779

CCOC(=O)c1c(Oc2ccc3c(c2)OCO3)cccc1Oc1cccc2c1OCO2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
MGAM O43451 1/20 0.46
AMY1A P0DUB6 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
RAB9A P51151 6/20 0.44
NPC1 O15118 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 3/20 0.44
TSHR P16473 2/20 0.44
PRKCI P41743 1/20 0.44
PRKCZ Q05513 1/20 0.44
TP53 P04637 3/20 0.43
MAPK1 P28482 1/20 0.43
PTGS2 P35354 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 5/20 0.42
ALOX15 P16050 3/20 0.42
HSD17B10 Q99714 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
SCHEMBL7797772 0.92 MAPT (0.54) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL7800988 0.87 MAPT (0.50) MAPTRAB9ANPC1SMN1; SMN2TSHR
SCHEMBL7799670 0.87 MAPT (0.48) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL7799781 0.86 RAB9A (0.50) MAPTRAB9ANPC1SMN1; SMN2TSHR
SCHEMBL7797700 0.85 MAPT (0.47) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL7790974 0.85 MAPT (0.50) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL7801002 0.84 MAOB (0.43) MAPTGAARAB9ANPC1SMN1; SMN2
SCHEMBL7799669 0.83 MAPT (0.46) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL7800900 0.83 MAPT (0.47) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL7791661 0.83 MAPT (0.45) MAPTRAB9ANPC1SMN1; SMN2LMNA

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-20010014694-A1 Substituted phenyl compounds and derivatives thereof that modulate the activity of endothelin ENCYSIVE PHARMACEUTICALS, INC. 2001-08-16 US disclosed
US-6265428-B1 VASODILATION TEXAS BIOTECHNOLOGY CORPORATION 2001-07-24 US disclosed
US-5977117-A Substituted phenyl compounds and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORPORATION (US) 1999-11-02 US disclosed
EP-0876364-A2 SUBSTITUTED PHENYL COMPOUNDS AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-11-11 EP disclosed
WO-1997025321-A2 SUBSTITUTED PHENYL COMPOUNDS AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1997-07-17 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-20010014694-A1 Substituted phenyl compounds and derivatives thereof that modulate the activity of endothelin EDNRA, EDNRB, NPR1 MAPT 4496/4885MGAM 4838/4885AMY1A 4157/4885

“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.