SCHEMBL4843343

SCHEMBL4843343

C[C@H](N)C(=O)N(C(=O)Cc1cc(F)cc(F)c1)[C@H]1C=CC[C@H](c2ccccc2)NC1=O

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.34
SMYD3 Q9H7B4 1/20 0.32
PSEN1 P49768 2/20 0.31
PSEN2 P49810 2/20 0.31
APH1B Q8WW43 2/20 0.31
NCSTN Q92542 2/20 0.31
APH1A Q96BI3 2/20 0.31
PSENEN Q9NZ42 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
GPR88 Q9GZN0 1/20 0.30
CCR5 P51681 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL4834293 1.00 HCRTR1 (0.34) HCRTR1SMYD3PSEN1PSEN2APH1B
SCHEMBL4842040 0.84 NR1I2 (0.33) HCRTR1
SCHEMBL4842681 0.84 NR1I2 (0.33) HCRTR1
SCHEMBL4833028 0.84 NR1I2 (0.33) HCRTR1
SCHEMBL4845733 0.84 NR1I2 (0.33) HCRTR1
SCHEMBL4833533 0.84 NR1I2 (0.33) HCRTR1
SCHEMBL4833875 0.82 PSEN1 (0.34) SMYD3PSEN1PSEN2APH1BNCSTN
SCHEMBL4842169 0.82 PSEN1 (0.34) SMYD3PSEN1PSEN2APH1BNCSTN
SCHEMBL4840828 0.82 PSEN1 (0.34) SMYD3PSEN1PSEN2APH1BNCSTN
SCHEMBL4842401 0.82 PSEN1 (0.34) SMYD3PSEN1PSEN2APH1BNCSTN

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
US-7342007-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2008-03-11 US claimed
US-20060183732-A1 Novel lactams and uses thereof ASTRAZENECA AB (SE) 2006-08-17 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 HCRTR1 3551/4885SMYD3 4425/4885PSEN1 6/4885

“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.