SCHEMBL4825866

SCHEMBL4825866

CCOc1cc(C=CC#N)ccc1OC

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 2/20 0.71
▸ PDE4A P27815 11/20 0.56
▸ PDE4B Q07343 11/20 0.56
▸ PDE4C Q08493 11/20 0.56
▸ PDE4D Q08499 11/20 0.56
▸ TUBB1 Q9H4B7 3/20 0.51
▸ AMY1A P0DUB6 1/20 0.49
▸ MAPT P10636 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ LMNA P02545 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
SCHEMBL4825864 1.00 FDPS (0.71) FDPSPDE4APDE4BPDE4CPDE4D
SCHEMBL4496389 0.87 FDPS (0.79) FDPSTUBB1MAPTKDM4E
SCHEMBL4496391 0.87 FDPS (0.79) FDPSTUBB1MAPTKDM4E
Hydrochloric Acid SCHEMBL27720316 0.85 FDPS (0.77) FDPSTUBB1MAPTKDM4E
SCHEMBL19019462 0.81 MAPT (0.64) PDE4APDE4BPDE4CPDE4DTUBB1
SCHEMBL7193653 0.81 MAPT (0.64) PDE4APDE4BPDE4CPDE4DTUBB1
SCHEMBL12687365 0.78 TUBB1 (0.72) TUBB1
SCHEMBL2761526 0.78 EGFR (0.64) PDE4APDE4BPDE4CPDE4DAMY1A
SCHEMBL4214927 0.78 FDPS (0.65) FDPSTUBB1KDM4E
SCHEMBL4214931 0.78 FDPS (0.65) FDPSTUBB1KDM4E

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 11 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-20080114061-A1 Diphenylethylene compounds and uses thereof CELGENE CORPORATION 2008-05-15 — — US disclosed
US-7312241-B2 Diphenylethylene compounds and uses thereof CELGENE CORPORATION (US) 2007-12-25 — — US disclosed
CN-101053558-A Diphenylethylene compounds and uses thereof CELGENE CORP (US) 2007-10-17 — — CN disclosed
EP-1799634-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2007-06-27 — — EP disclosed
EP-1603864-A4 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORP (US) 2007-04-11 — — EP disclosed
WO-2006026747-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2006-03-09 — — WO disclosed
EP-1603864-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2005-12-14 — — EP disclosed
US-20050107339-A1 Diphenylethylene compounds and uses thereof CELGENE CORPORATION 2005-05-19 — — US disclosed
US-20050014727-A1 Diphenylethylene compounds and uses thereof CELGENE CORPORATION 2005-01-20 — — US disclosed
WO-2004078144-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2004-09-16 — — 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 (3 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 FDPS 83/4885PDE4A 2547/4885PDE4B 2484/4885
US-20080114061-A1 Diphenylethylene compounds and uses thereof VHL, TNF, PTGES FDPS 83/4885PDE4A 2547/4885PDE4B 2484/4885
US-20050014727-A1 Diphenylethylene compounds and uses thereof VHL, TNF, PTGES FDPS 83/4885PDE4A 2547/4885PDE4B 2484/4885

“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.

Send feedback