SCHEMBL16619485

SCHEMBL16619485

CCn1nc(C=O)c2cc(C(F)(F)F)ccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.39
KCNH2 Q12809 3/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
BRD9 Q9H8M2 1/20 0.39
AR P10275 1/20 0.38
NPSR1 Q6W5P4 1/20 0.36
RORA P35398 1/20 0.36
RORC P51449 1/20 0.36
RORB Q92753 1/20 0.36
MAPT P10636 1/20 0.35
PDE4A P27815 3/20 0.35
PDE4B Q07343 3/20 0.35
PDE4C Q08493 3/20 0.35
PDE4D Q08499 3/20 0.35
HTR1A P08908 1/20 0.35

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
SCHEMBL18015902 0.78 PSEN1 (0.45) CCR2KCNH2PSEN1PSEN2APH1B
SCHEMBL17968831 0.78 BRD9 (0.44) CCR2KCNH2PSEN1PSEN2APH1B
SCHEMBL5583119 0.78 CCR2 (0.39) CCR2KCNH2PSEN1PSEN2APH1B
SCHEMBL18014728 0.75 PSEN1 (0.43) CCR2KCNH2PSEN1PSEN2APH1B
SCHEMBL28714426 0.74 PTGER4 (0.42) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL2661006 0.74 CCR2 (0.39) CCR2KCNH2PSEN1PSEN2APH1B
SCHEMBL24223871 0.73 KDM4E (0.46) ARNPSR1MAPT
SCHEMBL16619808 0.71 GAA (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30231151 0.70 CYP2C19 (0.49) MAPT
SCHEMBL24077079 0.70 CYP2C19 (0.49) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052495-B1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS PFIZER (US) 2019-06-26 EP disclosed
US-20160229847-A1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS PFIZER (US) 2016-08-11 US disclosed
EP-3052495-A1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS Pfizer Inc. (US) 2016-08-10 EP disclosed
WO-2015049616-A1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS PFIZER INC. (US) 2015-04-09 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-20160229847-A1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS BACE1, BACE2, PSEN2 CCR2 4551/4885KCNH2 2191/4885PSEN1 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.