SCHEMBL4392464

SCHEMBL4392464

CCc1c(O)cc(O)c(-c2ccccc2)c1Cc1ocnc1CO

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 3/20 0.37
USP7 Q93009 3/20 0.36
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
PDE4B Q07343 3/20 0.33
PDE4A P27815 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
POLB P06746 2/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
CNR2 P34972 2/20 0.32
MAPT P10636 1/20 0.31
CNR1 P21554 1/20 0.31
GPR55 Q9Y2T6 1/20 0.31
IDO1 P14902 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 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
SCHEMBL4388328 0.90 GCGR (0.39) GCGRUSP7ESR1ESR2PDE4B
SCHEMBL4393955 0.81 PTGIR (0.39) SMN1; SMN2CNR2MAPTCYP2C9
SCHEMBL4386746 0.79 EGFR (0.35) GCGRUSP7MAPT
SCHEMBL4379839 0.75 ADORA2A (0.35) USP7ESR1ESR2POLBRECQL
SCHEMBL4379007 0.73 ADORA2A (0.44) USP7ESR1ESR2POLBRECQL
SCHEMBL4386943 0.72 ESR1 (0.42) GCGRUSP7ESR1ESR2PDE4B
SCHEMBL4384129 0.71 PTGIR (0.41) CNR2CYP2C9
SCHEMBL4392482 0.71 PTGIR (0.36) USP7
SCHEMBL4379268 0.71 PTGIR (0.42) SMN1; SMN2MAPT
SCHEMBL4387388 0.71 ESR1 (0.44) GCGRUSP7ESR1ESR2PDE4B

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 GCGR 263/4885USP7 413/4885ESR1 610/4885

“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.