SCHEMBL1795119

SCHEMBL1795119

CC(C)CC(C(=O)O)c1cc(NC(=O)c2cc(F)cc(F)c2)cc(-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.67
PSEN2 P49810 3/20 0.67
APH1B Q8WW43 3/20 0.67
NCSTN Q92542 3/20 0.67
APH1A Q96BI3 3/20 0.67
PSENEN Q9NZ42 3/20 0.67
P2RY14 Q15391 3/20 0.47
APP P05067 1/20 0.44
PPARA Q07869 2/20 0.42
TRPA1 O75762 2/20 0.41
P2RX1 P51575 1/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MCHR1 Q99705 2/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL12615835 0.92 PSEN1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1798032 0.92 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1793876 0.91 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3655823 0.89 PSEN1 (0.74) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1796061 0.87 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL491667 0.85 PSEN1 (0.88) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL491520 0.85 PSEN1 (0.88) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL491899 0.85 PSEN1 (0.88) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2911516 0.85 PSEN1 (0.74) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3659242 0.84 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2212280-B1 AMIDE LINKED MODULATORS OF Y-SECRETASE JANSSEN PHARMACEUTICA NV (BE) 2013-12-04 EP disclosed
US-7951843-B2 Amide linked modulators of γ-secretase JANSSEN PHARMACEUTICA N.V. (BE) 2011-05-31 US disclosed
US-7951843-B2 Amide linked modulators of γ-secretase JANSSEN PHARMACEUTICA N.V. (BE) 2011-05-31 US disclosed
US-7951843-B2 Amide linked modulators of γ-secretase JANSSEN PHARMACEUTICA N.V. (BE) 2011-05-31 US disclosed
EP-2212280-A1 AMIDE LINKED MODULATORS OF Y-SECRETASE Janssen Pharmaceutica, N.V. (BE) 2010-08-04 EP disclosed
US-20090105345-A1 AMIDE LINKED MODULATORS OF Gamma-SECRETASE JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-23 US disclosed
US-20090105345-A1 AMIDE LINKED MODULATORS OF Gamma-SECRETASE JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-23 US disclosed
US-20090105345-A1 AMIDE LINKED MODULATORS OF Gamma-SECRETASE JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-23 US disclosed
WO-2009052079-A1 AMIDE LINKED MODULATORS OF Y-SECRETASE JANSSEN PHARMACEUTICA, N.V. (BE) 2009-04-23 WO disclosed
WO-2009052079-A1 AMIDE LINKED MODULATORS OF Y-SECRETASE JANSSEN PHARMACEUTICA, N.V. (BE) 2009-04-23 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-20090105345-A1 AMIDE LINKED MODULATORS OF Gamma-SECRETASE BACE1, BACE2, APH1A PSEN1 6/4885PSEN2 8/4885APH1B 4/4885

“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.