SCHEMBL4029561

SCHEMBL4029561

Cn1nc(-c2ccc(O)c(O)c2)c2cccc(F)c21

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.44
APP P05067 2/20 0.39
ALOX5 P09917 2/20 0.38
HPGD P15428 2/20 0.37
IDO1 P14902 1/20 0.37
SSTR4 P31391 1/20 0.35
JAK3 P52333 1/20 0.35
NAMPT P43490 1/20 0.35
GUSB P08236 1/20 0.35

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
SCHEMBL4026158 0.84 ESR1 (0.60) ESR1HPGDSSTR4NAMPT
SCHEMBL4025914 0.83 ESR1 (0.51) ESR1APPALOX5HPGDIDO1
SCHEMBL5397380 0.83 ESR1 (0.56) ESR1APPALOX5
SCHEMBL4027587 0.83 ESR1 (0.53) ESR1APPSSTR4
SCHEMBL6698490 0.83 ESR1 (0.53) ESR1APPALOX5IDO1
SCHEMBL4035727 0.81 ESR1 (0.57) ESR1
SCHEMBL4035132 0.78 ESR1 (0.56) ESR1
SCHEMBL4025988 0.73 NAMPT (0.48) ESR1APPSSTR4JAK3NAMPT
SCHEMBL4029614 0.73 ESR1 (0.39) ESR1APPALOX5JAK3NAMPT
SCHEMBL4028322 0.70 ESR1 (0.71) 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 1028/4885APP 4668/4885ALOX5 1481/4885

“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.