SCHEMBL312104

SCHEMBL312104

COc1c(C)cc(-c2cc(=O)c3ccccc3o2)cc1C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 11/20 0.66
SMN1; SMN2 Q16637 6/20 0.66
HPGD P15428 5/20 0.66
KDM4E B2RXH2 5/20 0.66
RAB9A P51151 5/20 0.66
CYP3A4 P08684 4/20 0.66
MAPT P10636 4/20 0.66
ALDH1A1 P00352 3/20 0.66
GLA P06280 3/20 0.66
NPC1 O15118 3/20 0.66
THRB P10828 2/20 0.66
HSD17B10 Q99714 2/20 0.66
MAOB P27338 2/20 0.66
TP53 P04637 2/20 0.66
LMNA P02545 1/20 0.66
KCNA5 P22460 1/20 0.66
KCNH2 Q12809 1/20 0.66
NLRP3 Q96P20 1/20 0.66
LCK P06239 1/20 0.65
ABCB1 P08183 2/20 0.63

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
SCHEMBL9528168 0.86 LCK (0.78) TNKSSMN1; SMN2HPGDKDM4ERAB9A
SCHEMBL28152153 0.85 TNKS (0.69) TNKSSMN1; SMN2HPGDKDM4ERAB9A
SCHEMBL312311 0.84 TNKS (0.64) TNKSSMN1; SMN2HPGDKDM4ERAB9A
SCHEMBL311443 0.82 FTO (0.73) TNKSSMN1; SMN2HPGDKDM4ERAB9A
3',5'-Dimethoxyflavone SCHEMBL29149133 0.82 TNKS (0.78) TNKSSMN1; SMN2HPGDKDM4ERAB9A
Flavone SCHEMBL28073133 0.80 TNKS (0.87) TNKSSMN1; SMN2HPGDKDM4ERAB9A
4'-Methoxyflavone SCHEMBL29573796 0.79 MAOB (1.00) TNKSSMN1; SMN2HPGDKDM4ERAB9A
4'-Methoxyflavone SCHEMBL311931 0.79 MAOB (1.00) TNKSSMN1; SMN2HPGDKDM4ERAB9A
Flavone SCHEMBL27686205 0.79 TNKS (0.84) TNKSSMN1; SMN2HPGDKDM4ERAB9A
SCHEMBL29149089 0.79 LCK (0.76) TNKSSMN1; SMN2HPGDKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242130-B2 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases RESVERLOGIX CORP. (CA) 2012-08-14 US disclosed
EP-1838296-B1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP (CA) 2012-08-08 EP disclosed
US-8093273-B2 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases RESVERLOGIX CORP. (CA) 2012-01-10 US disclosed
EP-2332527-A2 Flavanoids and Isoflavanoids for the prevention and treatment of cardiovascular diseases RESVERLOGIX CORP. (CA) 2011-06-15 EP disclosed
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP. (CA) 2009-10-15 US disclosed
EP-1838296-A2 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP. (CA) 2007-10-03 EP disclosed
US-20060205767-A1 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases HEPALINK (HONG KONG) LIMITED (HK) 2006-09-14 US disclosed
WO-2006045096-A2 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP. (CA) 2006-04-27 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 (2 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-20060205767-A1 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases APOB, APOL1, FABP3 TNKS 4486/4885SMN1; SMN2 2736/4885HPGD 138/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 TNKS 4486/4885SMN1; SMN2 2736/4885HPGD 138/4885

“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.