SCHEMBL4268685

SCHEMBL4268685

COC(=O)CCCCCOc1c2ccoc2c(OCCCCCC(=O)OC)c2oc(=O)ccc12

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNA2 P16389 1/20 0.60
▸ KDM4E B2RXH2 3/20 0.54
▸ CYP1A1 P04798 3/20 0.54
▸ CYP1A2 P05177 2/20 0.54
▸ CYP1B1 Q16678 2/20 0.54
▸ CYP3A4 P08684 2/20 0.54
▸ POLB P06746 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ABCB1 P08183 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ BACE1 P56817 3/20 0.51
▸ KCNA3 P22001 9/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ KCNA5 P22460 2/20 0.46

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
SCHEMBL4267157 0.83 KCNA3 (0.69) KCNA2KDM4ECYP1A1CYP1A2CYP3A4
SCHEMBL4274847 0.83 MAOA (0.65) KDM4ECYP1A2CYP1B1CYP3A4POLB
SCHEMBL13985912 0.78 MAOA (0.68) KCNA2KDM4ECYP1A1CYP1A2CYP1B1
SCHEMBL27293969 0.74 KCNA3 (0.65) KCNA2KDM4ECYP1A1CYP1A2CYP1B1
SCHEMBL31315053 0.72 CYP1B1 (0.88) KCNA2KDM4ECYP1A1CYP1A2CYP1B1
SCHEMBL20278630 0.72 KCNA2 (0.56) KCNA2KDM4ECYP1A1CYP1A2CYP1B1
SCHEMBL22091843 0.72 CNR2 (0.53) CYP1A2POLBHPGDMAPTALDH1A1
SCHEMBL22091769 0.72 CNR2 (0.53) CYP1A2POLBHPGDMAPTALDH1A1
SCHEMBL22091917 0.72 CNR2 (0.53) CYP1A2POLBHPGDMAPTALDH1A1
SCHEMBL22091903 0.72 CNR2 (0.53) CYP1A2POLBHPGDMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8802892-B2 Functionalized phenolic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2014-08-12 — — US disclosed
US-8802892-B2 Functionalized phenolic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2014-08-12 — — US disclosed
US-8802892-B2 Functionalized phenolic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2014-08-12 — — US disclosed
US-20130281652-A1 FUNCTIONALIZED PHENOLIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC 2013-10-24 — — US disclosed
US-20130281652-A1 FUNCTIONALIZED PHENOLIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC 2013-10-24 — — US disclosed
US-20130281652-A1 FUNCTIONALIZED PHENOLIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC 2013-10-24 — — US disclosed
US-8318973-B2 Functionalized sinapic acid and methyl sinapate BEZWADA BIOMEDICAL, LLC (US) 2012-11-27 — — US disclosed
US-8318973-B2 Functionalized sinapic acid and methyl sinapate BEZWADA BIOMEDICAL, LLC (US) 2012-11-27 — — US disclosed
US-8318973-B2 Functionalized sinapic acid and methyl sinapate BEZWADA BIOMEDICAL, LLC (US) 2012-11-27 — — US disclosed
US-20090170927-A1 FUNCTIONALIZED PHENOLIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2009-07-02 — — US disclosed
US-20090170927-A1 FUNCTIONALIZED PHENOLIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2009-07-02 — — US disclosed
US-20090170927-A1 FUNCTIONALIZED PHENOLIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2009-07-02 — — US disclosed
WO-2007053794-A2 FUNCTIONALIZED PHENOLIC COMPOUNDS AND ABSORBABLE THEREFROM BEZWADA BIOMEDICAL LLC (US) 2007-05-10 — — 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-20090170927-A1 FUNCTIONALIZED PHENOLIC COMPOUNDS AND POLYMERS THEREFROM COMT, AOX1, UGT1A6 KCNA2 3377/4885KDM4E 1444/4885CYP1A1 40/4885

“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.

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