SCHEMBL4387301

SCHEMBL4387301

COc1c(Br)c(O)cc(O)c1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.61
PDE4A P27815 5/20 0.57
PDE4C Q08493 5/20 0.57
PDE4D Q08499 5/20 0.57
MGAM O43451 2/20 0.46
GAA P10253 2/20 0.46
SI P14410 2/20 0.46
MGAM2 Q2M2H8 2/20 0.46
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
KDM1A O60341 1/20 0.40
CCNT1 O60563 1/20 0.40
PKM P14618 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
CCNA2 P20248 1/20 0.40
CCNC P24863 1/20 0.40
CDK2 P24941 1/20 0.40
GABRB3 P28472 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
SCHEMBL4381996 0.83 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DMGAM
SCHEMBL24049430 0.79 MGAM (0.56) PDE4BPDE4APDE4CPDE4DMGAM
SCHEMBL28221491 0.78 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL11776875 0.77 PDE4B (0.64) PDE4BPDE4APDE4CPDE4DGABRP
SCHEMBL4384039 0.76 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL21384700 0.75 PDE4B (0.55) PDE4BPDE4APDE4CPDE4DMGAM
SCHEMBL4389590 0.74 LMNA (0.50) PDE4BPDE4APDE4CPDE4DALDH1A1
Dimethylamine SCHEMBL4387430 0.74 PDE4B (0.42) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL17924583 0.74 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DMGAM
SCHEMBL4381978 0.73 PDE4B (0.40) PDE4BPDE4APDE4CPDE4DMEN1

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 PDE4B 4266/4885PDE4A 4374/4885PDE4C 4564/4885

“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.