SCHEMBL4384058

SCHEMBL4384058

CCc1c(OCOC)cc(OCOC)c(-c2ccccc2)c1CCc1ocnc1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.40
EGFR P00533 2/20 0.34
DHODH Q02127 1/20 0.33
DPP4 P27487 3/20 0.32
PTGIR P43119 2/20 0.31
CAPN1 P07384 1/20 0.31
FBP1 P09467 1/20 0.30
FYN P06241 1/20 0.30
FABP3 P05413 1/20 0.30
FABP4 P15090 1/20 0.30
FABP5 Q01469 1/20 0.30
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 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
SCHEMBL4384200 0.92 EGFR (0.38) ADORA2AEGFRDHODHPTGIRFBP1
SCHEMBL4387719 0.91 L3MBTL1 (0.35) EGFRPTGIRFBP1FYN
SCHEMBL4383980 0.86 PTGIR (0.39) EGFRPTGIR
SCHEMBL4387626 0.86 PTGIR (0.33) EGFRDHODHPTGIR
SCHEMBL4378282 0.85 PTGIR (0.35) EGFRPTGIR
SCHEMBL4384051 0.84 GCGR (0.35) EGFR
SCHEMBL4389505 0.83 PTGIR (0.36) EGFRPTGIR
SCHEMBL4381492 0.82 PTGIR (0.36) EGFRPTGIRFBP1
SCHEMBL4385894 0.81 EGFR (0.41) EGFRDHODHDPP4CAPN1FABP3
SCHEMBL4379007 0.80 ADORA2A (0.44) ADORA2ADPP4PTGIRFBP1

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 ADORA2A 3962/4885EGFR 624/4885DHODH 3584/4885

“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.