SCHEMBL17899518

SCHEMBL17899518

COc1cccc(OC)c1/C=C1\CN(C)C/C(=C\c2c(OC)cccc2OC)C1=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.58
LY96 Q9Y6Y9 1/20 0.57
IKBKB O14920 1/20 0.48
RAF1 P04049 1/20 0.48
RPS6KB1 P23443 1/20 0.48
MAPK1 P28482 1/20 0.48
AKT1 P31749 1/20 0.48
AKT2 P31751 1/20 0.48
KDR P35968 1/20 0.48
MAPKAPK2 P49137 1/20 0.48
PRKAG1 P54619 1/20 0.48
MAP2K1 Q02750 1/20 0.48
PRKAA1 Q13131 1/20 0.48
NEK1 Q96PY6 1/20 0.48
PRKAB1 Q9Y478 1/20 0.48
HTT P42858 2/20 0.47
MITF O75030 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL25842373 0.93 NFE2L2 (0.52) NFE2L2LY96IKBKBRAF1RPS6KB1
SCHEMBL17899579 0.83 MAPT (0.59) NFE2L2LY96MAPK1HTTLMNA
SCHEMBL17899533 0.83 SMN1; SMN2 (0.50) NFE2L2LY96HTTMITFLMNA
SCHEMBL17899561 0.83 ACHE (0.65) NFE2L2LY96IKBKBRAF1RPS6KB1
SCHEMBL31518795 0.83 ACHE (0.65) NFE2L2LY96IKBKBRAF1RPS6KB1
SCHEMBL17899557 0.82 NFE2L2 (0.77) NFE2L2LY96MAPTRAB9AACHE
SCHEMBL17899574 0.80 MEN1 (0.57) NFE2L2MAPK1HTTLMNAMAPT
SCHEMBL17899552 0.79 MAPT (0.56) LY96IKBKBMAPK1HTTLMNA
SCHEMBL25842387 0.78 MAPT (0.53) NFE2L2MAPK1HTTLMNAMAPT
SCHEMBL25842402 0.78 SMN1; SMN2 (0.45) NFE2L2LY96HTTMITFLMNA

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 7 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-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-11312676-B2 Small molecule stimulators of steroid receptor coactivator proteins and their use in the treatment of cancer BAYLOR COLLEGE OF MEDICINE (US) 2022-04-26 US disclosed
US-20210115017-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) 2021-04-22 US disclosed
US-10875841-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) 2020-12-29 US disclosed
US-20200071300-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) 2020-03-05 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 (6 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-20200071300-A1 Small Molecule Stimulators of Steroid Receptor Coactivator-3 and Methods of Their Use as Cardioprotective and/or Vascular Regenerative Agents NCOA3, FABP3, NCOA1 NFE2L2 1274/4885LY96 1393/4885IKBKB 533/4885
US-11312676-B2 Small molecule stimulators of steroid receptor coactivator proteins and their use in the treatment of cancer NCOA2, NCOA1, NCOA3 NFE2L2 1518/4885LY96 1243/4885IKBKB 509/4885
US-20210115017-A1 SMALL MOLECULE STIMULATORS OF STEROID RECEPTOR COACTIVATOR-3 AND METHODS OF THEIR USE AS CARDIOPROTECTIVE AND/OR VASCULAR REGENERATIVE AGENTS NCOA3, FABP3, NCOA1 NFE2L2 1274/4885LY96 1393/4885IKBKB 533/4885
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 NFE2L2 1274/4885LY96 1393/4885IKBKB 533/4885
US-10875841-B2 Small molecule stimulators of steroid receptor coactivator-3 and methods of their use as cardioprotective and/or vascular regenerative agents NCOA3, FABP3, NCOA1 NFE2L2 1274/4885LY96 1393/4885IKBKB 533/4885
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 NFE2L2 1274/4885LY96 1393/4885IKBKB 533/4885

“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.