SCHEMBL4822571

SCHEMBL4822571

COc1cc(OC)cc(C(O)c2cccc(OCc3ccccc3)c2)c1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.68
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 1/20 0.55
HPGD P15428 1/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
KMT2A Q03164 2/20 0.53
MRGPRX4 Q96LA9 1/20 0.52
MEN1 O00255 1/20 0.52
ALOX5 P09917 2/20 0.52
APP P05067 1/20 0.51
BCHE P06276 2/20 0.49

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
SCHEMBL10543846 0.90 MAOB (0.61) MAOBSMN1; SMN2LMNAHPGDALOX15
SCHEMBL477599 0.88 SMN1; SMN2 (0.62) MAOBSMN1; SMN2LMNAHPGDALOX15
SCHEMBL9367608 0.84 MAOB (0.68) MAOBSMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL17064305 0.83 MAOB (0.71) MAOBSMN1; SMN2LMNAHPGDALOX15
SCHEMBL31067669 0.83 MAOB (0.71) MAOBSMN1; SMN2LMNAHPGDALOX15
SCHEMBL791569 0.82 MAOB (1.00) MAOBMRGPRX4APPBCHE
SCHEMBL4822561 0.82 AOC3 (0.54) TSHRMAPK1
SCHEMBL4707722 0.82 ALOX5 (0.59) MAOBSMN1; SMN2LMNAHPGDALOX15
SCHEMBL7713126 0.82 SMN1; SMN2 (0.56) MAOBSMN1; SMN2LMNAHPGDALOX15
SCHEMBL6202972 0.81 MAOB (0.59) MAOBSMN1; SMN2LMNAHPGDALOX15

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 13 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
CN-101056846-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
CN-1780811-A Diphenylethylene compounds and uses thereof CELGENE CORP (US) 2006-05-31 CN 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 MAOB 2053/4885SMN1; SMN2 2969/4885LMNA 2114/4885
US-20080114061-A1 Diphenylethylene compounds and uses thereof VHL, TNF, PTGES MAOB 2053/4885SMN1; SMN2 2969/4885LMNA 2114/4885
US-20050014727-A1 Diphenylethylene compounds and uses thereof VHL, TNF, PTGES MAOB 2053/4885SMN1; SMN2 2969/4885LMNA 2114/4885

“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.