SCHEMBL5397266

SCHEMBL5397266

CCOc1cc(CCN(CCC(=O)O)C(=O)c2ccccc2-c2ccccc2C(=O)NCc2cccc(Cl)c2)ccc1OC

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 2/20 0.46
LMNA P02545 3/20 0.45
RAB9A P51151 1/20 0.44
TP53 P04637 2/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CTSD P07339 2/20 0.42
PDE10A Q9Y233 1/20 0.42
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42
HPGD P15428 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
SCHEMBL4929491 0.97 APEX1 (0.46) APEX1LMNARAB9ACTSDPDE10A
SCHEMBL5397722 0.94 APEX1 (0.49) APEX1LMNARAB9AMEN1KMT2A
SCHEMBL5436037 0.93 PTGDR2 (0.46) APEX1LMNARAB9ATP53MAPT
SCHEMBL5403132 0.93 LMNA (0.48) APEX1LMNARAB9ATP53MAPT
SCHEMBL5398768 0.92 LMNA (0.46) APEX1LMNARAB9ATP53MAPT
SCHEMBL5408530 0.92 RAB9A (0.55) APEX1LMNARAB9ATP53MAPT
SCHEMBL5392923 0.91 MEN1 (0.55) APEX1LMNARAB9ATP53MAPT
SCHEMBL4931927 0.90 LMNA (0.45) APEX1LMNAMAPTHPGD
SCHEMBL5403428 0.90 APP (0.49) APEX1LMNARAB9ATP53MAPT
SCHEMBL5392437 0.89 LMNA (0.46) LMNARAB9ATP53MAPTMEN1

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-7285680-B2 β-alanine derivatives and the use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-10-23 US disclosed
US-20050256160-A1 Beta-alanine derivatives and the use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2005-11-17 US disclosed
EP-1533294-A1 BETA-ALANINE DERIVATIVE AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-25 EP 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-20050256160-A1 Beta-alanine derivatives and the use thereof TGFB1, PML, APOB APEX1 2957/4885LMNA 308/4885RAB9A 3132/4885

“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.