SCHEMBL4820063

SCHEMBL4820063

CCOc1cc(Br)ccc1OC.[MgH2]

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.50
TSHR P16473 2/20 0.50
PDE4A P27815 6/20 0.49
PDE4B Q07343 6/20 0.49
PDE4C Q08493 6/20 0.49
PDE4D Q08499 6/20 0.49
KDM4E B2RXH2 2/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 1/20 0.47
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL1965362 0.98 HPGD (0.51) HPGDTSHRPDE4APDE4BPDE4C
SCHEMBL4572874 0.90 KDM4E (0.59) HPGDTSHRKDM4EGAAMAPT
SCHEMBL182753 0.88 TSHR (0.56) HPGDTSHRPDE4AKDM4EGAA
SCHEMBL31096231 0.88 TSHR (0.56) HPGDTSHRPDE4AKDM4EGAA
SCHEMBL1256865 0.83 CA2 (0.54) TSHRKDM4EMAPTSMN1; SMN2MAPK1
SCHEMBL21823421 0.83 HPGD (0.55) HPGDTSHRPDE4APDE4BPDE4D
SCHEMBL10080322 0.81 SMN1; SMN2 (0.52) HPGDPDE4APDE4BPDE4CPDE4D
SCHEMBL29419589 0.81 CA2 (0.56) TSHRKDM4EMAPTSMN1; SMN2MAPK1
SCHEMBL20509 0.81 CA2 (0.56) TSHRKDM4EMAPTSMN1; SMN2MAPK1
SCHEMBL2178750 0.81 KDM4E (0.45) TSHRKDM4EGAAMAPTSMN1; 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 HPGD 136/4885TSHR 4476/4885PDE4A 2547/4885

“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.