SCHEMBL1682471

SCHEMBL1682471

Cc1nn(-c2ccc(O)cc2)c(-c2c(C)noc2C)c1C(=N)NO

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 13/20 0.34
CREBBP Q92793 2/20 0.33
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
BRD2 P25440 1/20 0.32
USP2 O75604 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
CRACR2A Q9BSW2 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TAS2R8 Q9NYW2 1/20 0.31

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
SCHEMBL1682485 0.88 BRD4 (0.33) BRD4CYP1A2CYP2C9CYP2C19BRD2
SCHEMBL11898719 0.86 KDM4E (0.38) BRD4CYP1A2CYP2C9CYP2C19USP2
SCHEMBL15700290 0.86 BRD4 (0.35) BRD4CREBBPCYP1A2CYP2C9CYP2C19
SCHEMBL11898664 0.84 BRD4 (0.33) BRD4CREBBP
SCHEMBL1682549 0.83 BRD4 (0.35) BRD4CREBBPCYP1A2CYP2C19USP2
SCHEMBL1682440 0.81 AR (0.39) BRD4CREBBPCYP1A2CYP2C9CYP2C19
SCHEMBL1682465 0.79 BRD4 (0.34) BRD4CREBBPCYP1A2CYP2C9CYP2C19
SCHEMBL1682468 0.79 BRD4 (0.34) BRD4CREBBPCYP1A2CYP2C9CYP2C19
SCHEMBL1670810 0.79 BRD4 (0.34) BRD4CYP1A2CYP2C9CYP2C19BRD2
SCHEMBL12808000 0.78 SMN1; SMN2 (0.38) BRD4CREBBPCYP1A2CYP2C9CYP2C19

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486018-B1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2019-04-24 EP claimed
US-8921402-B2 Substituted pyrazoles as estrogen receptor ligands KARO BIO AB (SE) 2014-12-30 US claimed
US-20140128435-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2014-05-08 US claimed
US-8653112-B2 Substituted pyrazoles as estrogen receptor ligands KARO BIO AB (SE) 2014-02-18 US claimed
US-20120202853-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2012-08-09 US claimed
EP-3782616-B1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES UNIV CALIFORNIA (US) 2023-11-01 EP disclosed
US-11628146-B2 Estrogen receptor ligand treatment for neurodegenerative diseases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-04-18 US disclosed
EP-3782616-A1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES The Regents of The University of California (US) 2021-02-24 EP disclosed
US-20210008002-A1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-01-14 US disclosed
US-10758496-B2 Estrogen receptor ligand treatment for neurodegenerative diseases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-09-01 US disclosed
EP-3189026-B1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES UNIV CALIFORNIA (US) 2020-07-22 EP disclosed
EP-2486018-B1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO PHARMA AB (SE) 2019-04-24 EP disclosed
WO-2017031276-A1 METHODS OF PROVIDING NEUROPROTECTIVE THERAPY RELATED TO ADMINISTERING AN ESTROGEN RECEPTOR BETA LIGAND THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-23 WO disclosed
WO-2016036721-A1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-03-10 WO disclosed
US-8921402-B2 Substituted pyrazoles as estrogen receptor ligands KARO BIO AB (SE) 2014-12-30 US disclosed
US-20140128435-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2014-05-08 US disclosed
US-8653112-B2 Substituted pyrazoles as estrogen receptor ligands KARO BIO AB (SE) 2014-02-18 US disclosed
EP-2486018-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2012-08-15 EP disclosed
US-20120202853-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2012-08-09 US disclosed
WO-2011042475-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 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 (5 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-20210008002-A1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES ESR2, ESRRG, ESR1 BRD4 1609/4885CREBBP 1172/4885CYP1A2 2051/4885
US-20120202853-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS GPER1, ESR1, ESRRA BRD4 402/4885CREBBP 1392/4885CYP1A2 221/4885
US-11628146-B2 Estrogen receptor ligand treatment for neurodegenerative diseases ESR2, ESRRG, ESR1 BRD4 1609/4885CREBBP 1172/4885CYP1A2 2051/4885
US-20140128435-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS GPER1, ESR1, ESRRA BRD4 402/4885CREBBP 1392/4885CYP1A2 221/4885
US-10758496-B2 Estrogen receptor ligand treatment for neurodegenerative diseases ESR2, ESRRG, ESR1 BRD4 1609/4885CREBBP 1172/4885CYP1A2 2051/4885

“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.