SCHEMBL3857590

SCHEMBL3857590

Fc1cc(F)c(Cn2nc3c(C(F)(F)F)cccc3c2-c2cccc(N3CCC(N4CCOCC4)CC3)c2)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 13/20 0.44
NR1H3 Q13133 13/20 0.44
NR1I2 O75469 2/20 0.43
NR3C1 P04150 2/20 0.43
AR P10275 1/20 0.42
RXRA P19793 1/20 0.42
TRPV4 Q9HBA0 1/20 0.37
AOC3 Q16853 2/20 0.37
EED O75530 1/20 0.36
VCP P55072 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MET P08581 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
SCHEMBL1407766 0.94 NR1H2 (0.49) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1408329 0.91 NR1H2 (0.44) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407917 0.91 NR1H2 (0.41) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1408511 0.87 NR1H2 (0.48) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407102 0.85 NR1H2 (0.49) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1414584 0.85 NR1H2 (0.46) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1414302 0.84 NR1H2 (0.45) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL3861597 0.83 NR1H2 (0.46) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407646 0.82 NR1H2 (0.47) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407980 0.82 NR1H2 (0.48) NR1H2NR1H3NR1I2NR3C1AR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7592363-B2 Indazoles WYETH (US) 2009-09-22 US claimed
US-20060030612-A1 Indazoles useful in treating cardiovascular diseases WYETH (US) 2006-02-09 US claimed
US-7592363-B2 Indazoles WYETH (US) 2009-09-22 US disclosed
EP-1773781-A2 INDAZOLES USEFUL IN TREATING CARDIOVASCULAR DISEASES Wyeth (US) 2007-04-18 EP disclosed
WO-2006017384-A2 INDAZOLES USEFUL IN TREATING CARDIOVASCULAR DISEASES WYETH (US) 2006-02-16 WO disclosed
US-20060030612-A1 Indazoles useful in treating cardiovascular diseases WYETH (US) 2006-02-09 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 (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-20060030612-A1 Indazoles useful in treating cardiovascular diseases NR1H2, NR1H3, CYP46A1 NR1H2 1/4885NR1H3 2/4885NR1I2 6/4885

“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.