SCHEMBL6647724

SCHEMBL6647724

O=C(Nc1ccc(OCCn2cccn2)cc1)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
SMO Q99835 1/20 0.46
PRKAB2 O43741 1/20 0.45
PRKAG1 P54619 1/20 0.45
PRKAA2 P54646 1/20 0.45
PRKAA1 Q13131 1/20 0.45
PRKAG3 Q9UGI9 1/20 0.45
PRKAG2 Q9UGJ0 1/20 0.45
PRKAB1 Q9Y478 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
POLB P06746 2/20 0.45
LMNA P02545 1/20 0.45
MTTP P55157 8/20 0.44
ADAMTS7 Q9UKP4 1/20 0.44
APOB P04114 5/20 0.44
HDAC2 Q92769 1/20 0.44
GAA P10253 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL6644345 0.89 SMO (0.44) SMOTRPV1POLBLMNAMTTP
SCHEMBL6644462 0.88 GAA (0.47) SMOPOLBLMNAMTTPAPOB
SCHEMBL6646034 0.87 APOB (0.48) SMOTRPV1POLBLMNAMTTP
SCHEMBL6647101 0.86 PTGS1 (0.46) SMOTRPV1POLBMTTPADAMTS7
SCHEMBL6645353 0.85 THRB (0.51) THRBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL6646726 0.84 PTGS1 (0.46) SMOTRPV1POLBLMNAMTTP
SCHEMBL6648505 0.84 LMNA (0.48) SMOTRPV1POLBLMNAMTTP
SCHEMBL13683753 0.83 LMNA (0.50) THRBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL6647807 0.82 MTTP (0.42) SMOPOLBMTTPADAMTS7APOB
SCHEMBL6643863 0.81 THRB (0.46) THRBPRKAB2PRKAG1PRKAA2PRKAA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040133008-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-07-08 US disclosed
WO-2004039795-A2 AMIDE COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-13 WO 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-20040133008-A1 Amide compounds APOB, APOL1, LDLR THRB 340/4885SMO 4296/4885PRKAB2 4108/4885

“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.