SCHEMBL6397232

SCHEMBL6397232

CC(c1ccc(O)cc1)C(O)c1ccc(O)cc1SP(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
TYR P14679 1/20 0.32

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
SCHEMBL6399062 0.89 ESR1 (0.33) ESR1ESR2PDCD1CD274
SCHEMBL6402423 0.88 ADRB1 (0.42) ESR1ESR2TYR
SCHEMBL6398694 0.83 ESR1 (0.45) ESR1ESR2TYR
SCHEMBL6395712 0.81 ESR1 (0.32) ESR1ESR2PDCD1CD274
SCHEMBL6401106 0.80 ESR1 (0.36) ESR1ESR2PDCD1CD274TYR
SCHEMBL6397241 0.78 ESR1 (0.36) ESR1ESR2PDCD1CD274TYR
SCHEMBL6395098 0.77 ADRB1 (0.42) ESR1ESR2TYR
SCHEMBL6395641 0.76 ESR1 (0.32) ESR1ESR2PDCD1CD274
SCHEMBL6399069 0.75 ESR1 (0.36) ESR1ESR2PDCD1CD274TYR
SCHEMBL6403934 0.75 CYP3A4 (0.49) ESR1ESR2PDCD1CD274

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-20050187195-A1 Inhibition of intestinal apical membrane Na/phosphate co-transportation in humans PEERCE BRIAN E (US) 2005-08-25 US disclosed
US-20030162753-A1 Inhibition of intestinal apical membrane Na/phosphate co-transportation in humans BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2003-08-28 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 (2 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-20050187195-A1 Inhibition of intestinal apical membrane Na/phosphate co-transportation in humans SLC34A3, SLC34A1, SLC34A2 ESR1 2885/4885ESR2 2416/4885PDCD1 2817/4885
US-20030162753-A1 Inhibition of intestinal apical membrane Na/phosphate co-transportation in humans SLC34A3, SLC34A1, SLC34A2 ESR1 2885/4885ESR2 2416/4885PDCD1 2817/4885

“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.