SCHEMBL4207346

SCHEMBL4207346

CN1CCn2c(c(C3CCCCC3)c3ccc(C(=O)NC4(C(=O)Nc5ccc(C=CC(=O)O)cc5)CCCC4)cc32)-c2ccccc2C1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 18/20 0.67
CYP2C19 P33261 17/20 0.67
CYP2C9 P11712 6/20 0.66
CYP1A2 P05177 3/20 0.66
CYP2D6 P10635 4/20 0.50
KCNH2 Q12809 1/20 0.44

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
SCHEMBL4207341 1.00 CYP3A4 (0.67) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL12510307 0.99 CYP3A4 (0.67) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL14253169 0.91 CYP3A4 (0.67) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL4203790 0.91 CYP3A4 (0.62) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL4203784 0.91 CYP3A4 (0.62) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL4210984 0.90 CYP3A4 (0.62) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL4210975 0.90 CYP3A4 (0.62) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL14253363 0.88 CYP3A4 (0.62) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL2157426 0.87 CYP3A4 (0.52) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6
SCHEMBL2157435 0.87 CYP3A4 (0.52) CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6

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-20090149526-A1 Tetracyclic Indole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-06-11 US claimed
US-20090149526-A1 Tetracyclic Indole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-06-11 US disclosed
EP-1926733-A2 TETRACYCLIC INDOLE DERIVATIVES AS ANTIVIRAL AGENTS Istituto di Ricerche di Biologia Molecolare P. Angeletti (IT) 2008-06-04 EP disclosed
WO-2007029029-A2 TETRACYCLIC INDOLE DERIVATIVES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2007-03-15 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-20090149526-A1 Tetracyclic Indole Derivatives as Antiviral Agents IDO1, ZC3HAV1, ZC3HAV1L CYP3A4 234/4885CYP2C19 804/4885CYP2C9 456/4885

“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.