SCHEMBL3671019

SCHEMBL3671019

Oc1cc(OCc2ccccc2)cc(OCc2ccccc2)c1C/C=C/c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
KDM4E B2RXH2 2/20 0.50
PTGER4 P35408 2/20 0.49
PTGER3 P43115 2/20 0.49
PTGER2 P43116 2/20 0.49
CYP1A1 P04798 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP19A1 P11511 1/20 0.48
POLB P06746 1/20 0.46
UBE2N P61088 1/20 0.46
KMT2A Q03164 1/20 0.46
APP P05067 4/20 0.46
ALDH1A1 P00352 3/20 0.45
HPGD P15428 2/20 0.45
THRB P10828 1/20 0.45
HTT P42858 1/20 0.45
AKR1C3 P42330 1/20 0.44
LCK P06239 1/20 0.43
GSK3B P49841 1/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL14686061 0.93 CYP1A1 (0.48) LMNAKDM4EPTGER4PTGER3PTGER2
SCHEMBL14686059 0.93 CYP1A1 (0.48) LMNAKDM4EPTGER4PTGER3PTGER2
SCHEMBL14685936 0.93 CYP1A1 (0.48) LMNAKDM4EPTGER4PTGER3PTGER2
SCHEMBL14685934 0.93 CYP1A1 (0.48) LMNAKDM4EPTGER4PTGER3PTGER2
SCHEMBL22882733 0.90 CYP1A2 (0.53) LMNAKDM4ECYP1A1CYP1A2CYP19A1
SCHEMBL5110026 0.90 CYP1A2 (0.52) LMNAKDM4ECYP1A1CYP1A2CYP19A1
SCHEMBL5110021 0.90 CYP1A2 (0.52) LMNAKDM4ECYP1A1CYP1A2CYP19A1
SCHEMBL14686039 0.89 GSK3B (0.57) KDM4EPTGER4PTGER3PTGER2KMT2A
SCHEMBL14686038 0.89 GSK3B (0.57) KDM4EPTGER4PTGER3PTGER2KMT2A
SCHEMBL24074957 0.88 LCK (0.55) LMNAKDM4ECYP1A1CYP1A2CYP19A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100048920-A1 Preparation of (+)-Catechin, (-)-Epicatechin, (-)-Catechin, and (+)-Epicatechin and Their 5,7,3',4'-Tetra-O-Benzyl Analogues MARS, INCORPORATED (US) 2010-02-25 US disclosed
US-20100048920-A1 Preparation of (+)-Catechin, (-)-Epicatechin, (-)-Catechin, and (+)-Epicatechin and Their 5,7,3',4'-Tetra-O-Benzyl Analogues MARS, INCORPORATED (US) 2010-02-25 US disclosed
EP-1896443-A1 PREPARATION OF (+)-CATECHIN, (-)-EPICATECHIN, (-)-CATECHIN, (+)-EPICATECHIN, AND THEIR 5,7,3',4'-TETRA-O-BENZYL ANALOGUES MARS, INCORPORATED (US) 2008-03-12 EP disclosed
WO-2007002877-A1 PREPARATION OF (+)-CATECHIN, (-)-EPICATECHIN, (-)-CATECHIN, (+)-EPICATECHIN, AND THEIR 5,7,3',4'-TETRA-O-BENZYL ANALOGUES MARS, INCORPORATED (US) 2007-01-04 WO 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-20100048920-A1 Preparation of (+)-Catechin, (-)-Epicatechin, (-)-Catechin, and (+)-Epicatechin and Their 5,7,3',4'-Tetra-O-Benzyl Analogues HAAO, TES, HPD LMNA 1236/4885KDM4E 263/4885PTGER4 1097/4885

“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.