SCHEMBL19385691

SCHEMBL19385691

CNC(=O)c1c(-c2ccc(F)cc2)oc2ccc(-c3cc(C(=O)NC4(c5ncccn5)CC(O)C4)c(OC)cc3C)c(F)c12

nearest known ligand 0.85

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 6/20 0.65
KCNH2 Q12809 3/20 0.65
CYP3A4 P08684 5/20 0.51
NR1I2 O75469 1/20 0.45
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL19401444 0.94 CYP2C8 (0.65) CYP2C8KCNH2CYP3A4NR1I2TP53
SCHEMBL19401415 0.94 CYP2C8 (0.65) CYP2C8KCNH2CYP3A4NR1I2TP53
SCHEMBL2140602 0.93 CYP2C8 (0.75) CYP2C8KCNH2CYP3A4NR1I2TP53
SCHEMBL15285827 0.92 CYP2C8 (0.67) CYP2C8KCNH2CYP3A4NR1I2TP53
SCHEMBL9900023 0.92 CYP2C8 (0.67) CYP2C8KCNH2CYP3A4NR1I2
SCHEMBL22407278 0.91 CYP2C8 (0.66) CYP2C8KCNH2CYP3A4NR1I2TP53
SCHEMBL19401373 0.91 CYP2C8 (0.66) CYP2C8KCNH2CYP3A4NR1I2TP53
SCHEMBL19401313 0.91 CYP2C8 (0.68) CYP2C8KCNH2CYP3A4NR1I2
SCHEMBL19385726 0.90 CYP2C8 (0.65) CYP2C8KCNH2CYP3A4NR1I2TP53
SCHEMBL15298815 0.90 CYP2C8 (0.65) CYP2C8KCNH2CYP3A4NR1I2

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-11161837-B2 Benzofuran derivatives for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2021-11-02 US disclosed
US-11161837-B2 Benzofuran derivatives for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2021-11-02 US disclosed
US-20200291002-A1 BENZOFURAN DERIVATIVES FOR THE TREATMENT OF HEPATITIS C BRISTOL MYERS SQUIBB CO (US) 2020-09-17 US disclosed
US-20200291002-A1 BENZOFURAN DERIVATIVES FOR THE TREATMENT OF HEPATITIS C BRISTOL MYERS SQUIBB CO (US) 2020-09-17 US disclosed
WO-2017165233-A1 BENZOFURAN DERIVATIVES FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-28 WO disclosed
WO-2017165233-A1 BENZOFURAN DERIVATIVES FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-28 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-20200291002-A1 BENZOFURAN DERIVATIVES FOR THE TREATMENT OF HEPATITIS C HAVCR2, UGT2B7, GOT1 CYP2C8 57/4885KCNH2 3469/4885CYP3A4 94/4885
US-11161837-B2 Benzofuran derivatives for the treatment of hepatitis C HAVCR2, UGT2B7, GOT1 CYP2C8 57/4885KCNH2 3469/4885CYP3A4 94/4885

“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.