SCHEMBL312847

SCHEMBL312847

O=c1cc(-c2ccc(O)c(F)c2)[nH]c2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 5/20 0.67
CTSL P07711 5/20 0.67
HPGD P15428 7/20 0.63
LMNA P02545 6/20 0.63
KDM4E B2RXH2 4/20 0.60
TUBB4A P04350 1/20 0.60
TP53 P04637 1/20 0.60
TUBB P07437 1/20 0.60
TUBA3C P0DPH7 1/20 0.60
TUBA1B P68363 1/20 0.60
TUBA4A P68366 1/20 0.60
TUBB4B P68371 1/20 0.60
TUBB3 Q13509 1/20 0.60
TUBB2A Q13885 1/20 0.60
TUBB8 Q3ZCM7 1/20 0.60
TUBA3E Q6PEY2 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
TUBA1A Q71U36 1/20 0.60
HSD17B10 Q99714 1/20 0.60
TUBA1C Q9BQE3 1/20 0.60

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
SCHEMBL312542 0.87 CTSV (0.66) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL313903 0.86 ALDH1A1 (0.68) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL31439167 0.85 ALDH1A1 (0.48) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL31439163 0.85 ALDH1A1 (0.48) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL312439 0.82 RIPK1 (0.45) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL26722656 0.81 CTSV (0.63) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL6001399 0.80 CTSV (1.00) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL29411879 0.80 CTSV (1.00) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL311524 0.80 CTSV (0.75) CTSVCTSLHPGDLMNAKDM4E
SCHEMBL26847028 0.79 CTSV (0.65) CTSVCTSLHPGDLMNAKDM4E

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 6 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
US-20060205767-A1 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases HEPALINK (HONG KONG) LIMITED (HK) 2006-09-14 US 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 CTSV 3486/4885CTSL 3491/4885HPGD 138/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 CTSV 3486/4885CTSL 3491/4885HPGD 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.