SCHEMBL7573541

SCHEMBL7573541

NC(=O)C1(c2ccc(F)cc2)OC(=O)c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
PKM P14618 1/20 0.44
LMNA P02545 3/20 0.44
POLB P06746 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 1/20 0.44
ESR1 P03372 1/20 0.44
TP53 P04637 1/20 0.44
TYMS P04818 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
ESR2 Q92731 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GPR55 Q9Y2T6 1/20 0.44
CFTR P13569 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
SCHEMBL7571843 0.88 CFTR (0.54) GAAPKMLMNAPOLBMEN1
SCHEMBL1823331 0.75 CFTR (0.46) GAAPKMLMNAPOLBMEN1
SCHEMBL19021292 0.74 CFTR (0.73) GAAPKMLMNAPOLBMEN1
SCHEMBL18161908 0.73 LMNA (0.36) GAAPKMLMNAPOLBMEN1
SCHEMBL7843306 0.72 CFTR (0.46) GAAPKMLMNAPOLBMEN1
SCHEMBL19010401 0.69 CFTR (0.63) GAAPKMLMNAPOLBMEN1
SCHEMBL10680943 0.67 CFTR (0.41) GAAPKMLMNAPOLBMEN1
SCHEMBL4261355 0.66 NPSR1 (0.47) GAAPKMLMNAMEN1MAPT
SCHEMBL11249029 0.64 CFTR (0.55) GAAPKMLMNAPOLBMEN1
SCHEMBL7313184 0.63 PDK2 (0.49) LMNAMEN1MAPTKMT2ASMN1; SMN2

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-6448255-B1 ELEVATE HDL CHOLESTEROL CONCENTRATION; MAY BE USEFUL FOR TREATMENT OF ATHEROSCLEROTIC CONDITIONS AND CORONARY HEART DISEASE WYETH 2002-09-10 US disclosed
US-20020061900-A1 Imidazo-isoquinolin-5-one derivatives, pyrimido-isoquinolin-6-one derivatives and imidazo-naphthyridin-5-one derivatives AMERICAN HOME PRODUCTS CORPORATION 2002-05-23 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-20020061900-A1 Imidazo-isoquinolin-5-one derivatives, pyrimido-isoquinolin-6-one derivatives and imidazo-naphthyridin-5-one derivatives PPARD, FABP3, FFAR3 GAA 4776/4885PKM 3430/4885LMNA 983/4885

“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.