SCHEMBL4384766

SCHEMBL4384766

CCc1c(OCc2ccccc2)cc(OCc2ccccc2)c(-c2ccccc2)c1CCC(CO)CO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.41
MGAM O43451 3/20 0.37
GAA P10253 3/20 0.37
SI P14410 3/20 0.37
MGAM2 Q2M2H8 3/20 0.37
MAPK14 Q16539 1/20 0.36
C5AR1 P21730 1/20 0.35
LIPE Q05469 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GCGR P47871 2/20 0.34
FFAR4 Q5NUL3 1/20 0.34
CDK1 P06493 2/20 0.34
CCNB1 P14635 2/20 0.34
GSK3B P49841 2/20 0.34
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34

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
SCHEMBL4382835 0.87 CYP4F2 (0.43) HMGCRMGAMGAASIMGAM2
SCHEMBL4385971 0.80 EGFR (0.37) GCGRUSP7
SCHEMBL4388315 0.78 HMGCR (0.38) HMGCRMGAMGAASIMGAM2
SCHEMBL4389711 0.78 CYP4F2 (0.41) MAPTMAPK1TDP1L3MBTL1FFAR4
SCHEMBL4383171 0.78 PTGER1 (0.48) HMGCRMAPK14FFAR4PTGER1PTGER4
SCHEMBL4385645 0.76 MAPK14 (0.41) GAAMAPK14LIPEMAPTMAPK1
SCHEMBL4381086 0.76 ALDH1A1 (0.42) GAARAB9A
SCHEMBL4380278 0.75 HPGD (0.42) MAPK14PTGER1PTGER4PTGER3PTGER2
SCHEMBL4381132 0.75 EGFR (0.39) HMGCRGCGRUSP7
SCHEMBL4383090 0.75 LTA4H (0.43) NPC1RAB9A

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 HMGCR 2948/4885MGAM 4288/4885GAA 3950/4885

“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.