SCHEMBL4035119

SCHEMBL4035119

Cn1nc(-c2ccc(O)cc2O)c2ccc(C(F)(F)F)cc21

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 14/20 0.74
SCN9A Q15858 2/20 0.44
ESR2 Q92731 2/20 0.41
KIF11 P52732 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HSP90AA1 P07900 1/20 0.38
ADORA2A P29274 1/20 0.38

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
SCHEMBL4027782 0.84 SCN9A (0.57) ESR1SCN9AKIF11KDM4EALDH1A1
SCHEMBL4035750 0.83 ESR1 (0.62) ESR1SCN9AESR2HSP90AA1
SCHEMBL4029390 0.79 SCN9A (0.52) ESR1SCN9AKIF11KDM4EALDH1A1
SCHEMBL4035851 0.77 ESR1 (0.59) ESR1ESR2
SCHEMBL5418980 0.75 ALDH1A1 (0.63) SCN9AKIF11KDM4EALDH1A1
SCHEMBL4030033 0.75 ESR1 (0.72) ESR1ESR2ALDH1A1
SCHEMBL5407109 0.74 ESR1 (0.67) ESR1ESR2
SCHEMBL4030717 0.73 MAPK1 (0.53) ESR1SCN9AKIF11KDM4EALDH1A1
SCHEMBL4027869 0.73 ESR1 (0.65) ESR1ESR2
SCHEMBL13106180 0.72 ADORA2A (0.53) SCN9AKIF11KDM4EALDH1A1ADORA2A

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
EP-1542976-B1 SUBSTITUTED 4-(INDAZOL-3-YL)PHENOLS AS ESTROGEN RECEPTOR (ER) LIGANDS AND THEIR USE IN THE TREATMENT OF INFLAMMATORY DISEASES WYETH CORP (US) 2009-02-04 EP disclosed
US-20070225349-A1 Substituted 4-(Indazol-3-yl)phenols WYETH (US) 2007-09-27 US disclosed
US-7241791-B2 Substituted 4-(indazol-3-yl)phenols WYETH (US) 2007-07-10 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 (1 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-20070225349-A1 Substituted 4-(Indazol-3-yl)phenols INSR, TNNI3, INSRR ESR1 1028/4885SCN9A 1161/4885ESR2 621/4885

“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.