SCHEMBL4387053

SCHEMBL4387053

COC(=O)Cc1c(Br)c(O)cc(O)c1-c1ccc(CCC(C)=O)o1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.36
ALDH1A1 P00352 9/20 0.36
KDM4E B2RXH2 6/20 0.36
PKM P14618 5/20 0.36
HSD17B10 Q99714 5/20 0.35
HPGD P15428 4/20 0.35
NPSR1 Q6W5P4 2/20 0.35
RXFP1 Q9HBX9 2/20 0.35
TSHR P16473 2/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
GAA P10253 2/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
DDAH1 O94760 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL4389142 0.93 ALDH1A1 (0.37) MAPTALDH1A1KDM4EPKMHSD17B10
SCHEMBL4394113 0.81 MAPT (0.33) MAPTALDH1A1KDM4EPKMHSD17B10
SCHEMBL4389601 0.80 ALDH1A1 (0.38) MAPTALDH1A1KDM4EPKMHSD17B10
SCHEMBL4394076 0.75 ALDH1A1 (0.42) MAPTALDH1A1KDM4EHSD17B10HPGD
SCHEMBL4388730 0.74 ALDH1A1 (0.34) MAPTALDH1A1KDM4EPKMHSD17B10
SCHEMBL4383921 0.73 ALDH1A1 (0.42) MAPTALDH1A1KDM4EPKMHSD17B10
SCHEMBL4379801 0.71 L3MBTL1 (0.43) ALDH1A1KDM4EPKMHPGDTSHR
SCHEMBL4387065 0.71 MAPT (0.35) MAPTALDH1A1KDM4EPKMHSD17B10
SCHEMBL4387564 0.70 ALDH1A1 (0.35) MAPTALDH1A1KDM4EPKMHSD17B10
SCHEMBL4387566 0.70 ALDH1A1 (0.35) MAPTALDH1A1KDM4EPKMHSD17B10

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 3520/4885KDM4E 3223/4885

“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.