SCHEMBL5479840

SCHEMBL5479840

CC(=O)C=Cc1ccc(Cl)c(F)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IAPP P10997 1/20 0.54
PTGS1 P23219 1/20 0.54
APP P05067 3/20 0.47
GLA P06280 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KCNA3 P22001 1/20 0.45
FDPS P14324 1/20 0.44
PYGL P06737 7/20 0.44
PTGS2 P35354 2/20 0.42
MCL1 Q07820 1/20 0.41
TUBB1 Q9H4B7 1/20 0.40

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
SCHEMBL5479835 1.00 IAPP (0.54) IAPPPTGS1APPGLATDP1
SCHEMBL28529134 0.86 IAPP (0.54) IAPPPTGS1APPGLATDP1
SCHEMBL29373808 0.86 IAPP (0.54) IAPPPTGS1APPGLATDP1
SCHEMBL13858839 0.84 PYGL (0.45) TDP1KCNA3PYGLPTGS2
SCHEMBL13858840 0.84 PYGL (0.45) TDP1KCNA3PYGLPTGS2
SCHEMBL1344144 0.84 KDM4E (0.53) APPGLATDP1KCNA3PYGL
SCHEMBL1344147 0.84 KDM4E (0.53) APPGLATDP1KCNA3PYGL
SCHEMBL556337 0.84 IAPP (0.59) IAPPPTGS1APPGLATDP1
SCHEMBL1344557 0.84 PYGL (0.60) IAPPPTGS1APPGLATDP1
SCHEMBL1344558 0.84 PYGL (0.60) IAPPPTGS1APPGLATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070112015-A1 Substituted dihydropyridines and methods of use CHEMOCENTRYX, INC. (US) 2007-05-17 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-20070112015-A1 Substituted dihydropyridines and methods of use C3AR1, C5AR1, C5AR2 IAPP 1199/4885PTGS1 1012/4885APP 1426/4885

“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.