SCHEMBL758934

SCHEMBL758934

COc1cc(C(=O)NCCc2ccc(Cl)cc2)ccc1-n1cnc(C)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 9/20 1.00
PSEN2 P49810 9/20 1.00
APH1B Q8WW43 9/20 1.00
NCSTN Q92542 9/20 1.00
APH1A Q96BI3 9/20 1.00
PSENEN Q9NZ42 9/20 1.00
GAA P10253 1/20 0.55
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
TP53 P04637 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 3/20 0.48
TSHR P16473 1/20 0.47
MCHR1 Q99705 1/20 0.47

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
SCHEMBL6852512 0.90 PSEN1 (0.82) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL755910 0.90 PSEN1 (0.81) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL758281 0.89 PSEN1 (0.79) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759484 0.86 PSEN1 (0.76) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL758946 0.85 PSEN1 (0.74) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL756527 0.85 PSEN1 (0.74) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6852566 0.85 PSEN1 (0.73) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL760359 0.84 PSEN1 (0.73) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853837 0.84 PSEN1 (0.73) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL756417 0.84 PSEN1 (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053165-A1 Novel Phenyl Imidazoles and Phenyl Triazoles As Gamma-Secretase Modulators PFIZER INC. (US) 2012-03-01 US disclosed
WO-2011059048-A1 NOVEL AMIDE DERIVATIVE 大日本住友製薬株式会社 (JP) 2011-05-19 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-20120053165-A1 Novel Phenyl Imidazoles and Phenyl Triazoles As Gamma-Secretase Modulators BACE1, BACE2, PSEN1 PSEN1 3/4885PSEN2 4/4885APH1B 7/4885

“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.