SCHEMBL4386486

SCHEMBL4386486

COC(=O)Cc1cc(O)cc(O)c1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.47
EGFR P00533 3/20 0.44
HSP90AB1 P08238 1/20 0.44
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL4388539 0.97 HSP90AB1 (0.46) ACLYEGFRHSP90AB1NPC1PKM
SCHEMBL4381578 0.90 GPR84 (0.44) ACLYEGFRHSP90AB1HPGDSMN1; SMN2
SCHEMBL4381689 0.86 MEN1 (0.45) EGFRHSP90AB1NPC1HPGDRAB9A
SCHEMBL6025217 0.85 CCNC (0.45) ACLYEGFRHSP90AB1ALDH1A1ESR1
SCHEMBL4387171 0.85 HSD17B1 (0.44) EGFRHSP90AB1PKMHPGDSMN1; SMN2
SCHEMBL4382035 0.83 HDAC4 (0.46) ACLYEGFRHSP90AB1HPGDSMN1; SMN2
SCHEMBL4390501 0.82 CNR2 (0.48) EGFRHSP90AB1NPC1PKMHPGD
SCHEMBL4384676 0.82 CFD (0.42) EGFRHSP90AB1HPGDALDH1A1MEN1
SCHEMBL4389848 0.81 VEGFA (0.47) EGFRHSP90AB1ALDH1A1GAA
SCHEMBL4387297 0.81 MEN1 (0.46) EGFRHSP90AB1SMN1; SMN2MEN1KMT2A

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 ACLY 2383/4885EGFR 624/4885HSP90AB1 1/4885

“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.