SCHEMBL20764017

SCHEMBL20764017

O=C(Nc1cccc(F)c1)c1ccc(-c2ccc(CO)cc2)s1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESRRG P62508 15/20 0.76
MAPT P10636 2/20 0.75
TP53 P04637 1/20 0.75
ESR1 P03372 7/20 0.72
ESR2 Q92731 5/20 0.72
NPC1 O15118 2/20 0.63
RAB9A P51151 2/20 0.63
KDM4E B2RXH2 1/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
PPARG P37231 1/20 0.56
NCOA2 Q15596 1/20 0.56
NCOA1 Q15788 1/20 0.56
NCOA3 Q9Y6Q9 1/20 0.56
PTPN11 Q06124 2/20 0.55
PTPN2 P17706 1/20 0.55
PTPN1 P18031 1/20 0.54

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
SCHEMBL20764011 0.91 MAPT (0.76) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20746251 0.86 ESRRG (1.00) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20764078 0.85 ESRRG (0.79) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20764252 0.84 ESRRG (1.00) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20764036 0.81 ESRRG (1.00) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20764339 0.81 ESRRG (1.00) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20764057 0.81 ESRRG (0.76) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20764231 0.81 ESRRG (1.00) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20764280 0.80 ESRRG (1.00) ESRRGMAPTTP53ESR1ESR2
SCHEMBL20764010 0.79 ESRRG (0.91) ESRRGMAPTTP53ESR1ESR2

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-11795162-B2 Modulators of the estrogen-related receptor SAINT LOUIS UNIVERSITY (US) 2023-10-24 US disclosed
US-20200247792-A1 ERR INVERSE AGONISTS SAINT LOUIS UNIVERSITY (US) 2020-08-06 US disclosed
WO-2019036562-A1 ERR INVERSE AGONISTS SAINT LOUIS UNIVERSITY (US) 2019-02-21 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 (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-20200247792-A1 ERR INVERSE AGONISTS ESRRA, ESRRB, ESR2 ESRRG 4/4885MAPT 3634/4885TP53 2879/4885
US-11795162-B2 Modulators of the estrogen-related receptor ESR2, GPER1, ESRRG ESRRG 3/4885MAPT 4038/4885TP53 3812/4885

“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.