SCHEMBL5335763

SCHEMBL5335763

CC(=O)/C=C/c1ccc(C)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IAPP P10997 1/20 0.56
PTGS1 P23219 1/20 0.56
GPR183 P32249 1/20 0.50
APP P05067 3/20 0.49
GLA P06280 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
FDPS P14324 1/20 0.45
PTGS2 P35354 1/20 0.43
TUBB1 Q9H4B7 3/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
NFE2L2 Q16236 1/20 0.42
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
MAOA P21397 2/20 0.40
MAOB P27338 2/20 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
SCHEMBL5335769 1.00 IAPP (0.56) IAPPPTGS1GPR183APPGLA
SCHEMBL584806 0.86 GPR183 (0.53) GPR183APPGLATDP1HDAC1
SCHEMBL584807 0.86 GPR183 (0.53) GPR183APPGLATDP1HDAC1
SCHEMBL556337 0.85 IAPP (0.59) IAPPPTGS1APPGLATDP1
SCHEMBL556336 0.85 IAPP (0.59) IAPPPTGS1APPGLATDP1
SCHEMBL14926717 0.83 IAPP (0.61) IAPPPTGS1APPGLATDP1
SCHEMBL21986697 0.82 IAPP (0.71) IAPPPTGS1APPGLATDP1
SCHEMBL21986702 0.82 IAPP (0.71) IAPPPTGS1APPGLATDP1
SCHEMBL14926733 0.81 PELI1 (0.49) GPR183PTGS2HDAC1HDAC6GAA
SCHEMBL14926722 0.81 TTR (0.59) GPR183APPFDPSTUBB1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340634-B2 Polymer for use in liquid crystal alignment layer DIC CORPORATION (JP) 2016-05-17 US disclosed
US-9340634-B2 Polymer for use in liquid crystal alignment layer DIC CORPORATION (JP) 2016-05-17 US disclosed
US-20130116396-A1 POLYMER FOR USE IN LIQUID CRYSTAL ALIGNMENT LAYER DIC CORPORATION (JP) 2013-05-09 US disclosed
US-20130116396-A1 POLYMER FOR USE IN LIQUID CRYSTAL ALIGNMENT LAYER DIC CORPORATION (JP) 2013-05-09 US disclosed
US-20070112015-A1 Substituted dihydropyridines and methods of use CHEMOCENTRYX, INC. (US) 2007-05-17 US disclosed
US-20070112015-A1 Substituted dihydropyridines and methods of use CHEMOCENTRYX, INC. (US) 2007-05-17 US disclosed
US-20070112015-A1 Substituted dihydropyridines and methods of use CHEMOCENTRYX, INC. (US) 2007-05-17 US disclosed
WO-2007051062-A2 SUBSTITUTED DIHYDROPYRIDINES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-05-03 WO disclosed
WO-2007051062-A2 SUBSTITUTED DIHYDROPYRIDINES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-05-03 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-20070112015-A1 Substituted dihydropyridines and methods of use C3AR1, C5AR1, C5AR2 IAPP 1199/4885PTGS1 1012/4885GPR183 1593/4885

“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.