SCHEMBL4384445

SCHEMBL4384445

CCc1c(O)cc(O)c(-c2cccc(OC)c2)c1CCO

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
GCGR P47871 1/20 0.43
ACLY P53396 1/20 0.41
MAOB P27338 2/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
ERN1 O75460 1/20 0.38
ADORA1 P30542 1/20 0.37
DYRK1A Q13627 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
BACE1 P56817 1/20 0.36

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
SCHEMBL4385019 0.88 HDAC4 (0.43) HDAC4HDAC8GCGRACLYMAOB
SCHEMBL4388187 0.84 HDAC4 (0.39) HDAC4HDAC8GCGRACLYMAOB
SCHEMBL4382880 0.83 ESR1 (0.47) GCGR
SCHEMBL4388631 0.83 TSHR (0.46) HDAC4HDAC8GCGRACLYGRIN1
SCHEMBL4387388 0.82 ESR1 (0.44) GCGRCNR2BACE1
SCHEMBL4380714 0.81 HDAC4 (0.44) HDAC4HDAC8ACLYCNR1CNR2
SCHEMBL4386407 0.79 HDAC4 (0.37) HDAC4HDAC8GCGRACLYCNR1
SCHEMBL4381472 0.79 HDAC4 (0.37) HDAC4HDAC8GCGRACLYCNR1
SCHEMBL4381848 0.79 BRD4 (0.41) ERN1MAPK1
SCHEMBL4388418 0.75 TSHR (0.40) GCGRCNR2ERN1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 EP 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P HDAC4 985/4885HDAC8 94/4885GCGR 263/4885

“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.