SCHEMBL4821207

SCHEMBL4821207

C/C=C(/c1cc(OC)cc(OC)c1)c1ccc(OC)c([N+](=O)[O-])c1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.65
PDE4B Q07343 10/20 0.65
PDE4C Q08493 10/20 0.65
PDE4D Q08499 10/20 0.65
ALDH1A1 P00352 4/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
KMT2A Q03164 2/20 0.49
POLB P06746 2/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 1/20 0.47

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
SCHEMBL4821213 1.00 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL8269866 0.90 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL4825963 0.87 PDE4A (0.68) PDE4APDE4BPDE4CPDE4D
SCHEMBL4819624 0.87 PDE4A (0.68) PDE4APDE4BPDE4CPDE4D
SCHEMBL4819618 0.87 PDE4A (0.68) PDE4APDE4BPDE4CPDE4D
SCHEMBL4818681 0.83 ALDH1A1 (0.59) ALDH1A1CYP3A4TSHRTDP1KMT2A
SCHEMBL4824357 0.81 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL4824365 0.81 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL4816976 0.79 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL4816968 0.79 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D

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-7470723-B2 Diphenylethylene compounds and uses thereof CELGENE CORPORATION (US) 2008-12-30 US disclosed
US-20050107339-A1 Diphenylethylene compounds and uses thereof CELGENE CORPORATION 2005-05-19 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-20050107339-A1 Diphenylethylene compounds and uses thereof VHL, TNF, PTGES PDE4A 2547/4885PDE4B 2484/4885PDE4C 2542/4885

“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.