SCHEMBL5527587

SCHEMBL5527587

COc1cccc(OC[C@H]2CC[C@@](O)(CNC(=O)c3ccc(O)cc3)CC2)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
ALDH1A1 P00352 1/20 0.44
GAA P10253 2/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
KCNH2 Q12809 2/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
CNR2 P34972 2/20 0.42
GRIN2B Q13224 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 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
SCHEMBL5527593 1.00 LMNA (0.48) LMNAHPGDALDH1A1GAAPOLB
SCHEMBL5527590 1.00 LMNA (0.48) LMNAHPGDALDH1A1GAAPOLB
SCHEMBL5525742 0.90 LMNA (0.45) LMNAHPGDALDH1A1GAAPOLB
SCHEMBL5525736 0.90 LMNA (0.45) LMNAHPGDALDH1A1GAAPOLB
SCHEMBL5525731 0.90 LMNA (0.45) LMNAHPGDALDH1A1GAAPOLB
SCHEMBL5515591 0.90 POLB (0.49) LMNAPOLBKMT2ACNR2
SCHEMBL5515584 0.90 POLB (0.49) LMNAPOLBKMT2ACNR2
SCHEMBL5515587 0.90 POLB (0.49) LMNAPOLBKMT2ACNR2
SCHEMBL5526202 0.88 SLC6A3 (0.45) CNR2
SCHEMBL5520711 0.88 CNR2 (0.44) CNR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 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-20070167452-A1 Therapeutic amide derivatives GRIN1, GRIN2B, GRIN3A LMNA 4506/4885HPGD 604/4885ALDH1A1 1187/4885

“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.