SCHEMBL5236458

SCHEMBL5236458

COc1ncccc1-c1ccc([CH]C(N)=O)cc1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.43
HPGD P15428 3/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
CYP11B1 P15538 2/20 0.42
CYP11B2 P19099 2/20 0.42
CYP19A1 P11511 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 3/20 0.41
LMNA P02545 2/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
AMY1A P0DUB6 1/20 0.41
MAPT P10636 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
SCHEMBL2011438 0.77 LTA4H (0.42) PDE4APDE4BPDE4CPDE4DCYP11B1
SCHEMBL5236465 0.77 LTA4H (0.42) PDE4APDE4BPDE4CPDE4DCYP11B1
SCHEMBL4988927 0.74 DHODH (0.49)
SCHEMBL14514408 0.70 LTA4H (0.60) APPMAPT
SCHEMBL20581328 0.69 MEN1 (0.50) HPGDCYP11B1CYP11B2CYP19A1ALDH1A1
SCHEMBL20394170 0.68 RAB9A (0.57) ALDH1A1LMNAMAPT
SCHEMBL1609269 0.66 KDM4E (0.79) APPHPGDPDE4APDE4BPDE4C
SCHEMBL1609268 0.66 KDM4E (0.79) APPHPGDPDE4APDE4BPDE4C
SCHEMBL752160 0.66 ALDH1A1 (0.65) APPALDH1A1KDM4ELMNAHTT
SCHEMBL29377794 0.66 ALDH1A1 (0.65) APPALDH1A1KDM4ELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070149577-A1 Compounds with medicinal effects due to interaction with the glucocorticoid receptor N.V. ORGANON (NL) 2007-06-28 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-20070149577-A1 Compounds with medicinal effects due to interaction with the glucocorticoid receptor NR3C1, NR3C2, MC2R APP 3798/4885HPGD 1665/4885PDE4A 794/4885

“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.