SCHEMBL4382457

SCHEMBL4382457

CCc1c(OCc2ccccc2)cc(OCc2ccccc2)c(-c2cc(C)cc(C)c2)c1CC1O[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)O1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK14 Q16539 2/20 0.33
DHODH Q02127 1/20 0.32
TACR1 P25103 2/20 0.31
BRD4 O60885 1/20 0.31
STAT3 P40763 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MCL1 Q07820 2/20 0.31
GRM5 P41594 1/20 0.31
SLC5A2 P31639 1/20 0.31
SYK P43405 1/20 0.30
TSPO P30536 1/20 0.30
MAOB P27338 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
SCHEMBL4382854 0.92 MAPT (0.34) MAPTMAPK1TDP1L3MBTL1MAPK14
SCHEMBL4385084 0.92 MAPK14 (0.35) MAPTMAPK1TDP1L3MBTL1MAPK14
SCHEMBL4381387 0.92 MAPK14 (0.35) MAPTMAPK1TDP1L3MBTL1MAPK14
SCHEMBL4384038 0.92 MAPK14 (0.35) MAPTMAPK1TDP1L3MBTL1MAPK14
SCHEMBL4386419 0.86 ESR1 (0.36) MAPTMAPK1TDP1L3MBTL1MCL1
SCHEMBL4386156 0.86 ESR1 (0.36) MAPTMAPK1TDP1L3MBTL1MCL1
SCHEMBL4386470 0.86 AR (0.36) MAPK14BRD4MCL1
SCHEMBL4380968 0.86 AR (0.36) MAPK14BRD4MCL1
SCHEMBL4387026 0.85 MCL1 (0.34) MAPTMAPK1TDP1L3MBTL1MCL1
SCHEMBL4381280 0.85 MCL1 (0.34) MAPTMAPK1TDP1L3MBTL1MCL1

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 2443/4885MAPK1 839/4885TDP1 2978/4885

“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.