SCHEMBL6480569

SCHEMBL6480569

COc1c(C(C)C)cc(C(=O)c2c(C)oc3ccccc23)cc1C(C)C

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 7/20 0.61
EYA3 Q99504 4/20 0.57
THRA P10827 1/20 0.54
THRB P10828 1/20 0.54
CYP2C9 P11712 3/20 0.51
KDM7A Q6ZMT4 1/20 0.45
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
L3MBTL1 Q9Y468 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
SCHEMBL6490125 0.86 EYA3 (0.69) CYP2C19EYA3THRATHRBCYP2C9
SCHEMBL6482824 0.85 THRA (0.72) CYP2C19EYA3THRATHRBCYP2C9
SCHEMBL27586552 0.82 CYP2C19 (0.64) CYP2C19EYA3THRATHRBCYP2C9
SCHEMBL8994709 0.76 CYP2C19 (1.00) CYP2C19EYA3CYP2C9KDM7AL3MBTL1
SCHEMBL28245008 0.75 CYP2C19 (0.79) CYP2C19EYA3THRATHRBCYP2C9
SCHEMBL18018241 0.73 CYP2C19 (0.61) CYP2C19EYA3CYP2C9POLBGAA
SCHEMBL3219908 0.73 EYA3 (1.00) CYP2C19EYA3THRATHRBCYP2C9
SCHEMBL6731441 0.73 GLRA1 (0.43) CYP2C19CYP2C9POLBGAA
SCHEMBL28245012 0.72 CYP2C19 (0.79) CYP2C19EYA3THRATHRBCYP2C9
SCHEMBL8994710 0.71 CYP2C19 (1.00) CYP2C19EYA3THRATHRBCYP2C9

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-20050065208-A1 Benzofuranes and their use in the treatment of atrial fibrillation KARO BIO AB (SE) 2005-03-24 US disclosed
CN-1533274-A Benzofuranes and their use in treatment of artrial fibrillation �����ɷ� 2004-09-29 CN disclosed
EP-1408958-A1 BENZOFURANES AND THEIR USE IN THE TREATMENT OF ATRIAL FIBRILLATION KARO BIO AB (SE) 2004-04-21 EP disclosed
WO-2003009839-A1 BENZOFURANES AND THEIR USE IN THE TREATMENT OF ATRIAL FIBRILLATION KARO BIO AB (SE) 2003-02-06 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-20050065208-A1 Benzofuranes and their use in the treatment of atrial fibrillation KCNH1, KCNJ2, KCNQ2 CYP2C19 240/4885EYA3 3572/4885THRA 1678/4885

“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.