SCHEMBL4820072

SCHEMBL4820072

CCOc1cc([Mg]Br)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.47
PDE4B Q07343 7/20 0.47
PDE4C Q08493 6/20 0.47
PDE4D Q08499 6/20 0.47
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.45
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
AMY1A P0DUB6 1/20 0.41
CALM1 P0DP23 1/20 0.41
DYRK1A Q13627 1/20 0.40
PDE3A Q14432 1/20 0.40

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
SCHEMBL1021384 0.85 CA2 (0.48) PDE4AKDM4EMAPK1ALDH1A1TSHR
SCHEMBL3151542 0.79 HTT (0.45) KDM4EGAAMAPTMAPK1ALDH1A1
SCHEMBL1965362 0.76 HPGD (0.51) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL4820063 0.74 HPGD (0.50) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL1021779 0.73 ALOX15 (0.42) KDM4EMAPTMAPK1ALDH1A1HPGD
SCHEMBL28996996 0.73 ACHE (0.35) KDM4EMAPTALDH1A1
SCHEMBL7903433 0.73 ACHE (0.68) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL9865319 0.73 KDM4E (0.52) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL12093645 0.73 CA12 (0.68) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL2447390 0.72 MEN1 (0.54) KDM4EMAPTALDH1A1HPGDSMN1; SMN2

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 4 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
EP-1799634-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2007-06-27 EP disclosed
WO-2006026747-A2 DIPHENYLETHYLENE COMPOUNDS AND USES THEREOF CELGENE CORPORATION (US) 2006-03-09 WO 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.