SCHEMBL13879685

SCHEMBL13879685

CCOC(=O)CCNC(=O)/C=C/c1ccc(Sc2ccc(F)cc2)cc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
MAPK14 Q16539 1/20 0.38
LMNA P02545 3/20 0.37
TP53 P04637 1/20 0.37
ITGAL P20701 1/20 0.37
PELI1 Q96FA3 2/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LY96 Q9Y6Y9 1/20 0.35
MAOB P27338 3/20 0.35
RXFP1 Q9HBX9 1/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
DRD4 P21917 1/20 0.35
DRD5 P21918 1/20 0.35

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
SCHEMBL13879687 0.86 MAOB (0.40) SMN1; SMN2LMNATP53ITGALALDH1A1
SCHEMBL13879679 0.84 SMN1; SMN2 (0.41) SMN1; SMN2LMNATP53ITGALALDH1A1
SCHEMBL13879612 0.79 GAA (0.41) SMN1; SMN2MAPK14LMNATP53ITGAL
SCHEMBL13879678 0.76 CYP3A4 (0.52) SMN1; SMN2LMNAALDH1A1KDM4EMAPT
SCHEMBL13879684 0.75 MAOB (0.39) SMN1; SMN2LMNAITGALALDH1A1MAPT
SCHEMBL13879675 0.74 ITGAL (0.40) LMNAITGALALDH1A1MAPTL3MBTL1
SCHEMBL13879681 0.74 ITGB2 (0.51) ITGALALDH1A1KDM4EMAPTL3MBTL1
SCHEMBL13879686 0.73 ITGB2 (0.52) SMN1; SMN2ITGALALDH1A1KDM4EGAA
SCHEMBL13879653 0.72 ITGAL (0.52) LMNAITGALALDH1A1KDM4EGAA
SCHEMBL13879683 0.71 MAOB (0.53) SMN1; SMN2LMNATP53ALDH1A1KDM4E

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-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
WO-2007047146-A2 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. (US) 2007-04-26 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-20090099186-A1 INHIBITORS OF VIRAL REPLICATION EIF2AK2, HAVCR2, RTF2 SMN1; SMN2 2091/4885MAPK14 2839/4885LMNA 2024/4885

“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.