SCHEMBL4392082

SCHEMBL4392082

COCOc1cc(OCOC)c(-c2ccc(C=CC(C)=O)o2)c(C(Br)C(=O)OC)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HDAC8 Q9BY41 2/20 0.32
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
BACE1 P56817 2/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL4384171 0.89 ALDH1A1 (0.35) MAPTALDH1A1HDAC8HDAC3HDAC4
SCHEMBL4394118 0.82 MAPT (0.34) MAPTALDH1A1HDAC8HDAC3HDAC4
SCHEMBL4392354 0.80 MAPT (0.36) MAPTALDH1A1MEN1KMT2AHDAC8
SCHEMBL4392360 0.80 MAPT (0.36) MAPTALDH1A1MEN1KMT2AHDAC8
SCHEMBL4379685 0.77 L3MBTL1 (0.37) MAPTALDH1A1HDAC8HDAC3HDAC4
SCHEMBL4383931 0.76 HDAC1 (0.34) MAPTALDH1A1MEN1KMT2AHDAC8
SCHEMBL4383935 0.76 HDAC1 (0.34) MAPTALDH1A1MEN1KMT2AHDAC8
SCHEMBL4389131 0.75 EGFR (0.40) KMT2AHDAC8HDAC3HDAC4HDAC1
SCHEMBL4392077 0.74 MAPT (0.35) MAPTALDH1A1MEN1KMT2ABACE1
SCHEMBL4392073 0.74 MAPT (0.35) MAPTALDH1A1MEN1KMT2ABACE1

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 MAPT 2443/4885ALDH1A1 3520/4885MEN1 4784/4885

“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.