SCHEMBL4382854

SCHEMBL4382854

CCc1c(OCc2ccccc2)cc(OCc2ccccc2)c(-c2cccc(C)c2)c1CC1O[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)O1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LRRK2 Q5S007 1/20 0.33
FFAR1 O14842 5/20 0.33
MAPK14 Q16539 2/20 0.32
MAOB P27338 2/20 0.32
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PTGER1 P34995 3/20 0.31
PTGER4 P35408 2/20 0.31
PTGER3 P43115 2/20 0.31
PTGER2 P43116 2/20 0.31
MRGPRX4 Q96LA9 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
GSK3B P49841 1/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 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
SCHEMBL4382457 0.92 MAPT (0.33) MAPTMAPK1TDP1L3MBTL1MAPK14
SCHEMBL4385084 0.92 MAPK14 (0.35) MAPTMAPK1TDP1L3MBTL1MAPK14
SCHEMBL4384038 0.92 MAPK14 (0.35) MAPTMAPK1TDP1L3MBTL1MAPK14
SCHEMBL4381387 0.92 MAPK14 (0.35) MAPTMAPK1TDP1L3MBTL1MAPK14
SCHEMBL4386419 0.90 ESR1 (0.36) MAPTMAPK1TDP1L3MBTL1FFAR1
SCHEMBL4386156 0.90 ESR1 (0.36) MAPTMAPK1TDP1L3MBTL1FFAR1
SCHEMBL6025486 0.89 C5AR1 (0.37) MAPTMAPK1TDP1L3MBTL1LRRK2
SCHEMBL4392462 0.89 C5AR1 (0.37) MAPTMAPK1TDP1L3MBTL1LRRK2
SCHEMBL4380707 0.89 C5AR1 (0.37) MAPTMAPK1TDP1L3MBTL1LRRK2
SCHEMBL4383920 0.89 MAOB (0.41) MAPTLRRK2MAOBSMN1; SMN2GSK3B

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.