SCHEMBL11898569

SCHEMBL11898569

Cc1noc(C)c1-c1c(-c2ccc(O)cc2F)nn(C)c1C=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 5/20 0.43
HSP90AB1 P08238 1/20 0.37
NSD3 Q9BZ95 1/20 0.37
BRD4 O60885 8/20 0.36
ESR1 P03372 3/20 0.33
ESR2 Q92731 1/20 0.33
FFAR1 O14842 1/20 0.32
FTO Q9C0B1 1/20 0.32

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
SCHEMBL11898833 0.89 ESR1 (0.41) ERN1HSP90AB1BRD4ESR1ESR2
SCHEMBL11899128 0.88 NSD3 (0.38) ERN1HSP90AB1NSD3BRD4ESR1
SCHEMBL11899129 0.88 NSD3 (0.38) ERN1HSP90AB1NSD3BRD4ESR1
SCHEMBL20913310 0.88 NSD3 (0.38) ERN1HSP90AB1NSD3BRD4ESR1
SCHEMBL1682569 0.82 AR (0.39) ERN1HSP90AB1NSD3BRD4FFAR1
SCHEMBL11899886 0.81 ERN1 (0.50) ERN1NSD3BRD4ESR1ESR2
SCHEMBL1682601 0.78 HSP90AB1 (0.35) ERN1HSP90AB1NSD3BRD4ESR1
SCHEMBL1682605 0.78 HSP90AB1 (0.35) ERN1HSP90AB1NSD3BRD4ESR1
SCHEMBL11899095 0.78 HSP90AB1 (0.35) ERN1HSP90AB1NSD3BRD4ESR1
SCHEMBL1682294 0.77 ESR1 (0.40) ERN1HSP90AB1NSD3BRD4ESR1

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
EP-3782616-B1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES UNIV CALIFORNIA (US) 2023-11-01 EP disclosed
EP-3782616-A1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES The Regents of The University of California (US) 2021-02-24 EP disclosed
EP-3189026-B1 ESTROGEN RECEPTOR LIGAND TREATMENT FOR NEURODEGENERATIVE DISEASES UNIV CALIFORNIA (US) 2020-07-22 EP 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
US-20120202853-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2012-08-09 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-20120202853-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS GPER1, ESR1, ESRRA ERN1 690/4885HSP90AB1 3818/4885NSD3 881/4885
US-20140128435-A1 SUBSTITUTED PYRAZOLES AS ESTROGEN RECEPTOR LIGANDS GPER1, ESR1, ESRRA ERN1 690/4885HSP90AB1 3818/4885NSD3 881/4885

“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.