SCHEMBL1408262

SCHEMBL1408262

CCOC(=O)C1CCCN(c2ccc(-c3c4cccc(C(F)(F)F)c4nn3Cc3ccc(C)cc3C)cc2)C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 9/20 0.58
NR1H3 Q13133 9/20 0.58
NR1I2 O75469 2/20 0.43
NR3C1 P04150 2/20 0.43
AR P10275 1/20 0.43
RXRA P19793 1/20 0.43
ALDH1A1 P00352 5/20 0.42
MAPT P10636 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPSR1 Q6W5P4 4/20 0.42
MAPK1 P28482 3/20 0.42
KDM4E B2RXH2 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
BRD4 O60885 1/20 0.41

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
SCHEMBL1407326 0.91 NR1H2 (0.61) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407813 0.86 KDM4E (0.44) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL3858014 0.85 NR1H2 (0.63) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407156 0.80 NR1H2 (0.67) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407279 0.78 NR1H2 (0.58) NR1H2NR1H3NR1I2NR3C1ALDH1A1
SCHEMBL1407208 0.77 NR1H2 (0.47) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407381 0.77 NR1H2 (0.52) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL27730803 0.77 NR1H2 (0.54) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407377 0.75 NR1H2 (1.00) NR1H2NR1H3NR1I2NR3C1AR
SCHEMBL1407512 0.75 NR1H2 (0.84) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7592363-B2 Indazoles WYETH (US) 2009-09-22 US claimed
EP-1773781-A2 INDAZOLES USEFUL IN TREATING CARDIOVASCULAR DISEASES Wyeth (US) 2007-04-18 EP claimed
WO-2006017384-A2 INDAZOLES USEFUL IN TREATING CARDIOVASCULAR DISEASES WYETH (US) 2006-02-16 WO claimed
US-20060030612-A1 Indazoles useful in treating cardiovascular diseases WYETH (US) 2006-02-09 US claimed
EP-2295429-A1 3-((hetero)aryl)-indazoles as Liver X receptor (LXR) and Th-1 inhibitors for the treatment of cardiovascular diseases Wyeth LLC (US) 2011-03-16 EP disclosed
US-7592363-B2 Indazoles WYETH (US) 2009-09-22 US 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.