SCHEMBL4387592

SCHEMBL4387592

CCc1cc(-c2nc3ccccc3n2-c2ccccc2)c(O)cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.55
GAA P10253 3/20 0.55
KDM4E B2RXH2 3/20 0.55
MAPT P10636 2/20 0.55
LMNA P02545 1/20 0.54
PAX8 Q06710 1/20 0.54
ESR1 P03372 4/20 0.49
ESR2 Q92731 4/20 0.49
MAPK1 P28482 1/20 0.49
HTT P42858 1/20 0.49
GRIA1 P42261 1/20 0.45
CACNG8 Q8WXS5 1/20 0.45
CACNG2 Q9Y698 1/20 0.45
GSR P00390 1/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.42

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
SCHEMBL18659986 0.84 RECQL (0.63) RECQLGAAKDM4ELMNAESR1
SCHEMBL13926642 0.83 RECQL (0.56) RECQLGAAKDM4EMAPTESR1
SCHEMBL172871 0.81 RECQL (0.59) RECQLGAAKDM4EESR1ESR2
SCHEMBL4303255 0.78 RECQL (0.67) RECQLKDM4EMAPTLMNAESR1
SCHEMBL17385550 0.76 RECQL (0.65) RECQLKDM4EMAPTLMNAESR1
SCHEMBL27889547 0.76 RECQL (0.65) RECQLKDM4EMAPTLMNAESR1
SCHEMBL804584 0.76 RECQL (0.64) RECQLKDM4EMAPTESR1ESR2
SCHEMBL4381522 0.76 RECQL (0.46) RECQLGAAKDM4EMAPTESR1
SCHEMBL13085156 0.75 RECQL (0.71) RECQLKDM4EMAPTLMNAESR1
SCHEMBL27702413 0.75 RECQL (0.63) RECQLKDM4EMAPTLMNAESR1

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 RECQL 1489/4885GAA 3950/4885KDM4E 3223/4885

“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.