SCHEMBL14009587

SCHEMBL14009587

CS(=O)(=O)C12CC1c1ccccc1-c1c(C3CCCCC3)c3ccc(C(=O)O)cc3n1C2

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.48
MMP12 P39900 1/20 0.48
NR1I2 O75469 10/20 0.47
KCNH2 Q12809 7/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SCN5A Q14524 2/20 0.43
SCN9A Q15858 2/20 0.40

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
SCHEMBL14345108 0.91 PRKCA (0.49) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL14009766 0.91 PRKCA (0.49) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL13841676 0.85 NR1I2 (0.49) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL14110712 0.84 NR1I2 (0.49) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL13841704 0.84 KCNH2 (0.51) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL14009588 0.83 KCNH2 (0.47) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL13356098 0.80 NR1I2 (0.62) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL1734222 0.80 NR1I2 (0.65) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL13356029 0.79 KCNH2 (0.58) PRKCAMMP12NR1I2KCNH2CYP3A4
SCHEMBL4487739 0.79 NR1I2 (0.48) PRKCAMMP12NR1I2KCNH2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456167-B2 Cyclopropyl fused indolobenzazepine HCV NS5B inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed
US-20070275947-A1 Cyclopropyl Fused Indolobenzazepine HCV NS5B Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-11-29 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 (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-20070275947-A1 Cyclopropyl Fused Indolobenzazepine HCV NS5B Inhibitors HAVCR2, ZC3HAV1, HCCS PRKCA 3901/4885MMP12 4103/4885NR1I2 298/4885

“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.