SCHEMBL311823

SCHEMBL311823

O=c1cc(-c2ccc(O)cc2)[nH]c2cc(F)ccc12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.74
MEN1 O00255 3/20 0.74
KMT2A Q03164 3/20 0.74
HPGD P15428 6/20 0.73
LMNA P02545 5/20 0.73
ALDH1A1 P00352 5/20 0.68
CTSV O60911 2/20 0.61
CTSL P07711 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.57
ADORA2A P29274 1/20 0.48
ADORA1 P30542 1/20 0.48
FEN1 P39748 1/20 0.48
TUBB4A P04350 1/20 0.47
TP53 P04637 1/20 0.47
TUBB P07437 1/20 0.47
TUBA3C P0DPH7 1/20 0.47
TUBA1B P68363 1/20 0.47
TUBA4A P68366 1/20 0.47
TUBB4B P68371 1/20 0.47
TUBB3 Q13509 1/20 0.47

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
SCHEMBL312265 0.88 SMN1; SMN2 (0.74) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL312386 0.87 KDM4E (0.55) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL313903 0.85 ALDH1A1 (0.68) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL9874774 0.85 MEN1 (1.00) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL9389628 0.84 LMNA (1.00) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL312025 0.83 KDM4E (0.51) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL24686712 0.80 ALDH1A1 (1.00) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL311524 0.80 CTSV (0.75) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL31552890 0.80 KDM4E (0.51) KDM4EMEN1KMT2AHPGDLMNA
SCHEMBL311852 0.80 KDM4E (0.51) KDM4EMEN1KMT2AHPGDLMNA

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 KDM4E 3504/4885MEN1 4653/4885KMT2A 2842/4885
US-20090259048-A1 FLAVANOIDS AND ISOFLAVANOIDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, APOL1, FABP3 KDM4E 3504/4885MEN1 4653/4885KMT2A 2842/4885

“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.