SCHEMBL4032768

SCHEMBL4032768

OCCn1nc(-c2ccc(O)c(O)c2)c2cccc(C(F)(F)F)c21

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 11/20 0.77
ESR2 Q92731 1/20 0.49
RORC P51449 5/20 0.48
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
HSD17B1 P14061 1/20 0.34
HSD17B2 P37059 1/20 0.34

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
SCHEMBL4026357 0.87 ESR1 (1.00) ESR1ESR2RORCSCN5ASCN9A
SCHEMBL4029651 0.85 ESR1 (0.77) ESR1ESR2RORCNR1H2NR1H3
SCHEMBL4027587 0.83 ESR1 (0.53) ESR1ESR2RORCNR1H2NR1H3
SCHEMBL4035239 0.76 ESR1 (0.80) ESR1ESR2RORCNR1H2NR1H3
SCHEMBL4025242 0.75 ESR1 (0.44) ESR1RORCSCN5ASCN9A
SCHEMBL4197102 0.75 ESR1 (0.44) ESR1RORCSCN5ASCN9A
SCHEMBL4030678 0.74 ESR1 (0.77) ESR1ESR2RORCNR1H2NR1H3
SCHEMBL5397380 0.74 ESR1 (0.56) ESR1ESR2RORC
SCHEMBL4026335 0.74 ESR1 (0.75) ESR1ESR2
SCHEMBL4035727 0.72 ESR1 (0.57) ESR1

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 1028/4885ESR2 621/4885RORC 142/4885

“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.