SCHEMBL4387388

SCHEMBL4387388

CCc1c(O)cc(O)c(-c2ccccc2)c1CCO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.44
ESR2 Q92731 2/20 0.44
POLB P06746 2/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GCGR P47871 2/20 0.40
USP7 Q93009 2/20 0.40
PDE4B Q07343 3/20 0.40
PDE4A P27815 2/20 0.40
PDE4C Q08493 2/20 0.40
PDE4D Q08499 2/20 0.40
BACE1 P56817 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CNR2 P34972 1/20 0.37
ACMSD Q8TDX5 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL4386943 0.91 ESR1 (0.42) ESR1ESR2POLBRECQLSMN1; SMN2
SCHEMBL4382880 0.86 ESR1 (0.47) ESR1ESR2GCGRCYP1A2CYP3A4
SCHEMBL4386674 0.86 ESR1 (0.39) ESR1ESR2POLBRECQLSMN1; SMN2
SCHEMBL4386612 0.84 ESR1 (0.40) ESR1ESR2POLBRECQLSMN1; SMN2
SCHEMBL4377963 0.83 CNR2 (0.39) ESR1ESR2POLBRECQLSMN1; SMN2
SCHEMBL4391973 0.83 CNR2 (0.39) ESR1ESR2POLBRECQLSMN1; SMN2
SCHEMBL4387542 0.83 ESR1 (0.41) ESR1ESR2POLBRECQLSMN1; SMN2
SCHEMBL4386191 0.82 POLB (0.42) ESR1ESR2POLBRECQLSMN1; SMN2
SCHEMBL4384445 0.82 HDAC4 (0.43) GCGRBACE1CNR2
SCHEMBL4386201 0.82 ESR1 (0.38) ESR1ESR2POLBRECQLSMN1; SMN2

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 ESR1 610/4885ESR2 1033/4885POLB 3913/4885

“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.