SCHEMBL17899555

SCHEMBL17899555

O=C1/C(=C/c2ccc(Br)cc2)COC/C1=C\c1ccc(Br)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 7/20 0.58
BCHE P06276 1/20 0.56
ACHE P22303 1/20 0.56
PTGS2 P35354 1/20 0.56
EGFR P00533 1/20 0.51
XDH P47989 1/20 0.51
MAPT P10636 3/20 0.49
RAB9A P51151 3/20 0.49
ALDH1A1 P00352 2/20 0.49
PKM P14618 2/20 0.49
MAPK1 P28482 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
DRD3 P35462 1/20 0.49
JAK2 O60674 1/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 1/20 0.46
XBP1 P17861 1/20 0.46
PAX8 Q06710 1/20 0.46

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
SCHEMBL17899490 0.82 EGFR (0.69) BCHEACHEPTGS2EGFRXDH
SCHEMBL30969583 0.82 EGFR (0.69) BCHEACHEPTGS2EGFRXDH
SCHEMBL608355 0.81 CYP2C9 (0.70) APPBCHEACHEPTGS2EGFR
SCHEMBL608356 0.81 CYP2C9 (0.70) APPBCHEACHEPTGS2EGFR
SCHEMBL11504934 0.80 CYP1A2 (0.68) APPBCHEACHEPTGS2EGFR
SCHEMBL11504932 0.80 CYP1A2 (0.68) APPBCHEACHEPTGS2EGFR
SCHEMBL13074080 0.80 CYP1A2 (0.68) APPBCHEACHEPTGS2EGFR
SCHEMBL19615877 0.79 HSD11B1 (0.73) APPEGFRXDHMAPTRAB9A
SCHEMBL19615875 0.79 HSD11B1 (0.73) APPEGFRXDHMAPTRAB9A
SCHEMBL19629247 0.79 HSD11B1 (0.73) APPEGFRXDHMAPTRAB9A

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-20230357200-A1 SMALL MOLECULE STIMULATORS OF STEROID RECEPTOR COACTIVATOR-3 AND METHODS OF THEIR USE AS CARDIOPROTECTIVE AND/OR VASCULAR REGENERATIVE AGENTS BAYLOR COLLEGE OF MEDICINE (US) 2023-11-09 US disclosed
US-20230357200-A1 SMALL MOLECULE STIMULATORS OF STEROID RECEPTOR COACTIVATOR-3 AND METHODS OF THEIR USE AS CARDIOPROTECTIVE AND/OR VASCULAR REGENERATIVE AGENTS BAYLOR COLLEGE OF MEDICINE (US) 2023-11-09 US disclosed
US-11708350-B2 Small molecule stimulators of steroid receptor coactivator-3 and methods of their use as cardioprotective and/or vascular regenerative agents BAYLOR COLLEGE OF MEDICINE (US) 2023-07-25 US disclosed
US-11708350-B2 Small molecule stimulators of steroid receptor coactivator-3 and methods of their use as cardioprotective and/or vascular regenerative agents BAYLOR COLLEGE OF MEDICINE (US) 2023-07-25 US disclosed
WO-2016109470-A1 SMALL MOLECULE STIMULATORS OF STEROID RECEPTOR COACTIVATOR PROTEINS AND THEIR USE IN THE TREATMENT OF CANCER BAYLOR COLLEGE OF MEDICINE (US) 2016-07-07 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-11708350-B2 Small molecule stimulators of steroid receptor coactivator-3 and methods of their use as cardioprotective and/or vascular regenerative agents NCOA3, FABP3, NCOA1 APP 4523/4885BCHE 4473/4885ACHE 4659/4885
US-20230357200-A1 SMALL MOLECULE STIMULATORS OF STEROID RECEPTOR COACTIVATOR-3 AND METHODS OF THEIR USE AS CARDIOPROTECTIVE AND/OR VASCULAR REGENERATIVE AGENTS NCOA3, FABP3, NCOA1 APP 4523/4885BCHE 4473/4885ACHE 4659/4885

“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.