SCHEMBL3073408

SCHEMBL3073408

COC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CCN(C[C@H]1CCCN1C)Cc1cc(F)ccc1-3

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 5/20 0.41
HRH1 P35367 1/20 0.38
SCN9A Q15858 4/20 0.38
CHRM3 P20309 7/20 0.38
KCNH2 Q12809 2/20 0.36

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
SCHEMBL3088322 0.92 NR1I2 (0.41) NR1I2SCN9ACHRM3
SCHEMBL3084480 0.86 PRKCA (0.42) NR1I2SCN9AKCNH2
SCHEMBL3085776 0.84 NR1I2 (0.42) NR1I2SCN9AKCNH2
SCHEMBL3073381 0.80 NR1I2 (0.42) NR1I2SCN9AKCNH2
SCHEMBL3088937 0.79 NR1I2 (0.41) NR1I2SCN9AKCNH2
SCHEMBL3088482 0.78 PRKCA (0.50) NR1I2SCN9AKCNH2
SCHEMBL3083577 0.77 KCNH2 (0.45) NR1I2SCN9AKCNH2
SCHEMBL3083720 0.77 PRKCA (0.42) NR1I2SCN9AKCNH2
SCHEMBL3092618 0.76 NR1I2 (0.41) NR1I2SCN9A
SCHEMBL3097455 0.76 PRKCA (0.43) NR1I2SCN9AKCNH2

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-7795247-B2 Tetracyclic indole derivatives as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2010-09-14 US disclosed
EP-1807403-A2 TETRACYCLIC INDOLE DERIVATIVES AS ANTIVIRAL AGENTS Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2007-07-18 EP disclosed
US-20060100262-A1 Tetracyclic indole derivatives as antiviral agents ISTITUTO DI RICHERCHEDI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IRMB) (IT) 2006-05-11 US disclosed
WO-2006046030-A2 TETRACYCLIC INDOLE DERIVATIVES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2006-05-04 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-20060100262-A1 Tetracyclic indole derivatives as antiviral agents IDO1, ZC3HAV1, IDO2 NR1I2 144/4885HRH1 1244/4885SCN9A 3788/4885

“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.