SCHEMBL2654561

SCHEMBL2654561

COC(=O)c1cc(OCCc2ccsc2)c2cc(C)oc2c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
GCK P35557 7/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 3/20 0.36
PTGES O14684 1/20 0.34
ALOX5 P09917 1/20 0.34
KCNH2 Q12809 3/20 0.34
MAPT P10636 2/20 0.33
AR P10275 1/20 0.33
BCHE P06276 1/20 0.33
MAOA P21397 1/20 0.33
ACHE P22303 1/20 0.33
MAOB P27338 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90B1 P14625 1/20 0.33
TTR P02766 1/20 0.33

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
SCHEMBL5219604 0.87 GCK (0.52) GCKKCNH2
SCHEMBL13343240 0.80 GCK (0.61) GCKKCNH2
SCHEMBL990120 0.74 GCK (0.43) GCKMEN1KMT2ALMNAPTGES
SCHEMBL2653455 0.74 AR (0.41) TSHRGCKKCNH2MAPTAR
SCHEMBL2654537 0.71 KDM4E (0.43) TSHRGCKLMNAKCNH2MAPT
SCHEMBL5219286 0.70 MAOB (0.42) TSHRMEN1KMT2ALMNAMAPT
SCHEMBL5222914 0.70 NOX1 (0.42) TSHRGCKMEN1KMT2AKCNH2
SCHEMBL2657438 0.70 GCK (0.64) GCKLMNAPTGESALOX5MAPT
SCHEMBL2653764 0.67 LMNA (0.53) MEN1KMT2ALMNAMAPT
SCHEMBL23628951 0.64 MRGPRX1 (0.46) TSHRLMNAKCNH2MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709505-B2 Benzofuran derivatives, process for their preparation and intermediates thereof ASTRAZENECA AB (SE) 2010-05-04 US disclosed
EP-1578745-B1 BENZOFURAN DERIVATivES, PROCESS FOR THEIR PREPARATION AND INTERMEDIATES THEREOF ASTRAZENECA AB (SE) 2007-11-14 EP disclosed
US-20060058353-A1 Benzofuran derivatives, process for their preparation and intermediates thereof ASTRAZENECA AB (SE) 2006-03-16 US disclosed
EP-1578745-A1 BENZOFURAN DERIVATES, PROCESS FOR THEIR PREPARATION AND INTERMEDIATES THEREOF Astrazeneca AB (SE) 2005-09-28 EP disclosed
WO-2004046139-A1 BENZOFURAN DERIVATES, PROCESS FOR THEIR PREPARATION AND INTERMEDIATES THEREOF ASTRAZENECA AB (SE) 2004-06-03 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 (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-20060058353-A1 Benzofuran derivatives, process for their preparation and intermediates thereof GCK, PDK2, GCKR TSHR 1843/4885GCK 1/4885MEN1 2136/4885

“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.