SCHEMBL15026342

SCHEMBL15026342

O=c1c2c(O)cc(CO)cc2ccn1-c1ccc(O)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.47
ESR2 Q92731 4/20 0.47
ESRRA P11474 2/20 0.46
EGFR P00533 3/20 0.39
MIF P14174 2/20 0.38
POLB P06746 2/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL3058875 0.84 ESR1 (0.61) ESR1ESR2ESRRAEGFRMIF
SCHEMBL14924053 0.79 EGFR (0.51) ESR1ESR2ESRRAEGFRPOLB
SCHEMBL2592130 0.79 EGFR (0.62) ESR1ESR2ESRRAEGFRMIF
SCHEMBL15026344 0.76 EGFR (0.56) EGFRMAPTTP53
SCHEMBL2588545 0.72 EGFR (0.73) ESR1ESR2ESRRAEGFR
SCHEMBL2582121 0.68 ESR2 (0.56) ESR1ESR2ESRRAEGFR
SCHEMBL14924051 0.67 EGFR (0.54) ESR1ESR2ESRRAEGFRPOLB
SCHEMBL18381973 0.66 EGFR (0.35) EGFR
SCHEMBL14924128 0.66 MIF (0.41) MIFPOLBMAPTLMNATP53
SCHEMBL4274776 0.65 ESR1 (0.44) ESR1ESR2ESRRAMIFMAPT

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-9604931-B2 Nuclear receptor binding agents GTX, INC. (US) 2017-03-28 US disclosed
US-20170014401-A1 NUCLEAR RECEPTOR BINDING AGENTS GTX, INC. 2017-01-19 US disclosed
US-20130150403-A1 NUCLEAR RECEPTOR BINDING AGENTS VA Long Beach Healthcare System (US) 2013-06-13 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 (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-20170014401-A1 NUCLEAR RECEPTOR BINDING AGENTS ESRRB, ESRRG, ESRRA ESR1 28/4885ESR2 4/4885ESRRA 3/4885
US-20130150403-A1 NUCLEAR RECEPTOR BINDING AGENTS FABP3, NCOR1, NR3C2 ESR1 375/4885ESR2 42/4885ESRRA 16/4885

“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.