SCHEMBL4839870

SCHEMBL4839870

N[C@@H]1CC=C[C@@H](c2ccccc2)N(Cc2ccccc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
MAPT P10636 4/20 0.44
NPSR1 Q6W5P4 3/20 0.44
HTT P42858 2/20 0.44
TDP1 Q9NUW8 1/20 0.43
EHMT2 Q96KQ7 1/20 0.43
KMT2A Q03164 3/20 0.42
THRB P10828 1/20 0.42
ATM Q13315 1/20 0.42
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL4843507 1.00 ALDH1A1 (0.44) ALDH1A1MAPTNPSR1HTTTDP1
SCHEMBL5791105 1.00 ALDH1A1 (0.44) ALDH1A1MAPTNPSR1HTTTDP1
SCHEMBL4834022 0.82 GRM2 (0.33)
SCHEMBL4834368 0.82 GRM2 (0.33)
SCHEMBL5792149 0.81 MEN1 (0.36) ALDH1A1MAPTTDP1KMT2ATHRB
SCHEMBL4845496 0.81 MEN1 (0.36) ALDH1A1MAPTTDP1KMT2ATHRB
SCHEMBL4841082 0.79 ALDH1A1 (0.38) ALDH1A1MAPTNPSR1KMT2ATSHR
SCHEMBL4841551 0.79 ALDH1A1 (0.38) ALDH1A1MAPTNPSR1KMT2ATSHR
SCHEMBL5795559 0.79 ALDH1A1 (0.38) ALDH1A1MAPTNPSR1KMT2ATSHR
SCHEMBL8313398 0.78 ALDH1A1 (0.42) ALDH1A1MAPTNPSR1HTTTDP1

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 5 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 disclosed
US-7342007-B2 Lactams and uses thereof ASTRAZENECA AB (SE) 2008-03-11 US disclosed
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
WO-2004080983-A1 NOVEL LACTAMS AND USES THEREOF ASTRAZENECA AB (SE) 2004-09-23 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-20060183732-A1 Novel lactams and uses thereof BACE1, BACE2, APP ALDH1A1 2419/4885MAPT 45/4885NPSR1 2853/4885

“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.