SCHEMBL4382249

SCHEMBL4382249

C=Cc1c(OCOC)cc(OCOC)c(-c2ccccc2)c1CCCO

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.38
GCGR P47871 2/20 0.32
DHODH Q02127 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL4386982 0.84 EGFR (0.40) EGFRGCGRDHODHMEN1KMT2A
SCHEMBL4389328 0.83 EGFR (0.38) EGFRMEN1KMT2A
SCHEMBL4379817 0.82 EGFR (0.40) EGFRGCGRDHODHMEN1KMT2A
SCHEMBL4381486 0.81 EGFR (0.40) EGFRMEN1KMT2A
SCHEMBL4387688 0.79 EGFR (0.43) EGFRDHODHMEN1KMT2A
SCHEMBL4381984 0.77 EGFR (0.41) EGFRGCGRDHODH
SCHEMBL4386514 0.75 EGFR (0.37) EGFRGCGRDHODHMEN1KMT2A
SCHEMBL4378977 0.75 EGFR (0.37) EGFRGCGRDHODHMEN1KMT2A
SCHEMBL4384689 0.75 EGFR (0.38) EGFRMEN1KMT2A
SCHEMBL4386891 0.74 EGFR (0.41) EGFRGCGRDHODH

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 EGFR 624/4885GCGR 263/4885DHODH 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.