SCHEMBL3569335

SCHEMBL3569335

O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(OCCN1CCCC1)Cc1ccsc1-3

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.40
MMP12 P39900 1/20 0.40
SCN9A Q15858 3/20 0.36
ESR1 P03372 11/20 0.36
ESR2 Q92731 11/20 0.36
CSNK2A1 P68400 1/20 0.34
ENPP3 O14638 1/20 0.32
ACHE P22303 3/20 0.32
HTR1A P08908 2/20 0.32
CCR3 P51677 1/20 0.31
MEN1 O00255 1/20 0.31
PLD2 O14939 1/20 0.31
KDM1A O60341 1/20 0.31
NR1I2 O75469 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
C5 P01031 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
FYN P06241 1/20 0.31

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
SCHEMBL3567161 0.86 PRKCA (0.49) PRKCAMMP12SCN9AESR1ESR2
SCHEMBL3575065 0.83 SCN9A (0.39) PRKCAMMP12SCN9AESR1ESR2
SCHEMBL4920282 0.83 PRKCA (0.43) PRKCAMMP12SCN9AESR1ESR2
SCHEMBL3080110 0.80 PRKCA (0.45) PRKCAMMP12SCN9AESR1ESR2
Trifluoroacetic Acid SCHEMBL3097978 0.75 PRKCA (0.60) PRKCAMMP12SCN9AESR1ESR2
SCHEMBL3093288 0.75 PRKCA (0.48) PRKCAMMP12SCN9ACSNK2A1NR1I2
Trifluoroacetic Acid SCHEMBL3098231 0.74 PRKCA (0.50) PRKCAMMP12SCN9AESR1ESR2
SCHEMBL3569883 0.74 PRKCA (0.47) PRKCAMMP12SCN9AESR1ESR2
SCHEMBL3581080 0.73 SCN9A (0.38) PRKCAMMP12SCN9ANR1I2ALDH1A1
SCHEMBL3092706 0.73 PRKCA (0.46) PRKCAMMP12SCN9AESR1ESR2

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-7662809-B2 Tetracyclic indole derivatives as antiviral agents ISTITUTO DI RICHERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-02-16 US disclosed
US-20080261938-A1 Tetracyclic Indole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2008-10-23 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-20080261938-A1 Tetracyclic Indole Derivatives as Antiviral Agents IDO1, IDO2, HAVCR2 PRKCA 4232/4885MMP12 2495/4885SCN9A 3739/4885

“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.