SCHEMBL18033784

SCHEMBL18033784

CCNc1cc2oc(-c3ccc(F)cc3)c(C(=O)NC)c2cc1-c1cccc(C(=O)NC(C#N)c2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.43
CYP2C8 P10632 3/20 0.43
KCNH2 Q12809 2/20 0.39
NR1I2 O75469 1/20 0.39

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
SCHEMBL19821781 0.93 CYP3A4 (0.37) CYP3A4CYP2C8
SCHEMBL18033745 0.88 CYP3A4 (0.41) CYP3A4CYP2C8KCNH2
SCHEMBL18033743 0.88 CYP3A4 (0.40) CYP3A4CYP2C8KCNH2NR1I2
SCHEMBL18029185 0.85 CYP3A4 (0.46) CYP3A4CYP2C8KCNH2
SCHEMBL18033765 0.85
SCHEMBL17349642 0.82 CYP3A4 (0.44) CYP3A4CYP2C8KCNH2NR1I2
SCHEMBL18028931 0.82 CYP3A4 (0.42) CYP3A4CYP2C8KCNH2NR1I2
SCHEMBL18033740 0.82 CYP3A4 (0.37) CYP3A4CYP2C8KCNH2
SCHEMBL18033787 0.82 CYP3A4 (0.42) CYP3A4CYP2C8KCNH2NR1I2
SCHEMBL18002671 0.82 CYP3A4 (0.40) CYP3A4CYP2C8KCNH2NR1I2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180030017-A1 BENZOFURANS SUBSTITUTED WITH PRIMARY BENZAMIDE AS HCV INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-02-01 US disclosed
US-20180030017-A1 BENZOFURANS SUBSTITUTED WITH PRIMARY BENZAMIDE AS HCV INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-02-01 US disclosed
WO-2016133970-A1 BENZOFURANS SUBSTITUTED WITH PRIMARY BENZAMIDE AS HCV INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2016-08-25 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-20180030017-A1 BENZOFURANS SUBSTITUTED WITH PRIMARY BENZAMIDE AS HCV INHIBITORS ZC3HAV1, TMBIM6, EIF2AK2 CYP3A4 159/4885CYP2C8 64/4885KCNH2 2612/4885

“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.