SCHEMBL4842401

SCHEMBL4842401

C[C@H](N)C(=O)N(C(=O)Cc1cc(F)cc(F)c1)[C@H]1C=C[C@@H](c2ccccc2)CNC1=O

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.34
PSEN2 P49810 8/20 0.34
APH1B Q8WW43 8/20 0.34
NCSTN Q92542 8/20 0.34
APH1A Q96BI3 8/20 0.34
PSENEN Q9NZ42 8/20 0.34
SMYD3 Q9H7B4 1/20 0.32
FAAH O00519 1/20 0.32
MC4R P32245 1/20 0.31
PKM P14618 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
GPR88 Q9GZN0 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
CCR5 P51681 1/20 0.30

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
SCHEMBL4840828 1.00 PSEN1 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4843192 0.84 NR1I2 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4841548 0.84 NR1I2 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4833345 0.84 NR1I2 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4843365 0.83 PSEN1 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4845149 0.83 PSEN1 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4834293 0.82 HCRTR1 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4843343 0.82 HCRTR1 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4842540 0.80 SMYD3 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4842750 0.80 SMYD3 (0.34) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7342007-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2008-03-11 US claimed
US-7342007-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2008-03-11 US disclosed
US-20060183732-A1 Novel lactams and uses thereof ASTRAZENECA AB (SE) 2006-08-17 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-20060183732-A1 Novel lactams and uses thereof BACE1, BACE2, APP 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.