SCHEMBL4384082

SCHEMBL4384082

CCc1c(OCOC)cc(OCOC)c(-c2ccco2)c1CC(=O)N(C)CCOC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.34
MAPT P10636 5/20 0.33
KDM4E B2RXH2 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ADORA3 P0DMS8 2/20 0.32
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
P2RX3 P56373 1/20 0.31
ALDH1A1 P00352 3/20 0.31
PKM P14618 1/20 0.31
THRB P10828 2/20 0.31
PPARD Q03181 1/20 0.30
LCLAT1 Q6UWP7 1/20 0.30
MEN1 O00255 1/20 0.30
APAF1 O14727 1/20 0.30

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
SCHEMBL4393899 0.82 L3MBTL1 (0.36) L3MBTL1MAPTKDM4ETDP1NPSR1
SCHEMBL4380682 0.82 SIGMAR1 (0.40) KDM4ETP53HPGDSMN1; SMN2ALDH1A1
SCHEMBL4387756 0.80 ALDH1A1 (0.34) L3MBTL1MAPTKDM4ETDP1NPSR1
SCHEMBL4387141 0.78 LMNA (0.33) MAPTLMNA
SCHEMBL4379960 0.75 ALDH1A1 (0.39) L3MBTL1MAPTKDM4ETDP1NPSR1
SCHEMBL4382475 0.72 EGFR (0.37) MAPTLMNAALDH1A1
SCHEMBL4386207 0.72 LTB4R (0.34) MAPTKDM4ELMNAALDH1A1
SCHEMBL4380967 0.71 L3MBTL1 (0.36) L3MBTL1MAPTKDM4ETDP1P2RX3
SCHEMBL4381042 0.70 SIGMAR1 (0.40) MAPTTP53HPGDSMN1; SMN2ALDH1A1
SCHEMBL4379675 0.70 ALDH1A1 (0.39) L3MBTL1MAPTKDM4ETDP1NPSR1

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 L3MBTL1 3218/4885MAPT 2443/4885KDM4E 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.