SCHEMBL4392482

SCHEMBL4392482

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

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
TRPV1 Q8NER1 1/20 0.33
USP7 Q93009 2/20 0.33
HCRTR1 O43613 2/20 0.32
HCRTR2 O43614 2/20 0.32

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
SCHEMBL4379839 0.86 ADORA2A (0.35) PTGIRUSP7
SCHEMBL4379007 0.84 ADORA2A (0.44) PTGIRUSP7
SCHEMBL4379268 0.83 PTGIR (0.42) PTGIR
SCHEMBL4387626 0.82 PTGIR (0.33) PTGIRTRPV1
SCHEMBL4384125 0.80 PTGIR (0.39) PTGIR
SCHEMBL4384129 0.79 PTGIR (0.41) PTGIR
SCHEMBL4388328 0.79 GCGR (0.39) USP7
SCHEMBL4389162 0.76 L3MBTL1 (0.41) L3MBTL1TRPV1
SCHEMBL4395202 0.74 L3MBTL1 (0.42) L3MBTL1TRPV1
SCHEMBL4393955 0.73 PTGIR (0.39) PTGIRL3MBTL1

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 PTGIR 2990/4885L3MBTL1 3218/4885TRPV1 2108/4885

“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.