SCHEMBL4840837

SCHEMBL4840837

CC(C)CN1C(=O)[C@H](N(C(=O)Cc2cc(F)cc(F)c2)[C@@H](C)C(N)=O)CC=C[C@H]1c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.33
RECQL P46063 1/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
NPSR1 Q6W5P4 1/20 0.32
PSEN1 P49768 4/20 0.31
PSEN2 P49810 4/20 0.31
APH1B Q8WW43 4/20 0.31
NCSTN Q92542 4/20 0.31
APH1A Q96BI3 4/20 0.31
PSENEN Q9NZ42 4/20 0.31
GSAP A4D1B5 1/20 0.31
TP53 P04637 1/20 0.31
MDM2 Q00987 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL4841905 1.00 ALDH1A1 (0.35) ALDH1A1MAPTRECQLMEN1KMT2A
SCHEMBL4841265 0.92 MEN1 (0.39) ALDH1A1MAPTRECQLMEN1KMT2A
SCHEMBL4842513 0.92 MEN1 (0.39) ALDH1A1MAPTRECQLMEN1KMT2A
SCHEMBL4841625 0.90 NPSR1 (0.32) ALDH1A1MAPTRECQLMEN1KMT2A
SCHEMBL4833527 0.90 NPSR1 (0.32) ALDH1A1MAPTRECQLMEN1KMT2A
SCHEMBL4834185 0.85 XIAP (0.33) ALDH1A1PSEN1PSEN2APH1BNCSTN
SCHEMBL4833359 0.85 XIAP (0.33) ALDH1A1PSEN1PSEN2APH1BNCSTN
SCHEMBL4833768 0.85 XIAP (0.33) ALDH1A1PSEN1PSEN2APH1BNCSTN
SCHEMBL4838169 0.84 KMT2A (0.33) MEN1KMT2ANPSR1KDM4E
SCHEMBL4837715 0.84 KMT2A (0.33) MEN1KMT2ANPSR1KDM4E

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 ALDH1A1 2419/4885MAPT 45/4885RECQL 2957/4885

“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.