SCHEMBL10242364

SCHEMBL10242364

CNC(=O)c1c(-c2ccc(F)cc2)oc2ccc(-c3cc(C(C)=O)c(C)cc3C)cc12

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 6/20 0.59
CYP3A4 P08684 6/20 0.59
KCNH2 Q12809 3/20 0.58
NR1I2 O75469 1/20 0.55
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL1919859 0.92 CYP2C8 (0.62) CYP2C8CYP3A4KCNH2NR1I2
SCHEMBL2139914 0.90 CYP2C8 (0.58) CYP2C8CYP3A4KCNH2NR1I2
SCHEMBL2837517 0.87 CYP3A4 (0.51) CYP2C8CYP3A4KCNH2NR1I2CYP2C9
SCHEMBL12940351 0.87 CYP3A4 (0.51) CYP2C8CYP3A4KCNH2NR1I2CYP2C9
SCHEMBL10242360 0.85 CYP2C8 (0.58) CYP2C8CYP3A4KCNH2NR1I2
SCHEMBL10240833 0.84 CYP2C8 (0.58) CYP2C8CYP3A4KCNH2NR1I2CYP2C9
SCHEMBL1917995 0.84 CYP2C8 (0.54) CYP2C8CYP3A4KCNH2NR1I2
SCHEMBL142568 0.84 CYP2C8 (0.72) CYP2C8CYP3A4KCNH2NR1I2
SCHEMBL1918922 0.84 CYP2C8 (0.53) CYP2C8CYP3A4KCNH2NR1I2
SCHEMBL143697 0.84 CYP2C8 (0.55) CYP2C8CYP3A4KCNH2NR1I2

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-20130197012-A1 Compounds for the Treatment of Hepatitis C BRISTOL MYERS SQUIBB CO (US) 2013-08-01 US disclosed
US-20120316126-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2012-12-13 US disclosed
US-8309558-B2 Compounds for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2012-11-13 US disclosed
US-20120201783-A1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY 2012-08-09 US disclosed
US-8148382-B2 Compounds for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-03 US disclosed
US-20110256099-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2011-10-20 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 (4 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-20120316126-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 CYP2C8 85/4885CYP3A4 299/4885KCNH2 3814/4885
US-20130197012-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 CYP2C8 85/4885CYP3A4 299/4885KCNH2 3814/4885
US-20120201783-A1 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C HAVCR2, HCCS, SLC10A1 CYP2C8 85/4885CYP3A4 299/4885KCNH2 3814/4885
US-20110256099-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 CYP2C8 85/4885CYP3A4 299/4885KCNH2 3814/4885

“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.