SCHEMBL13879412

SCHEMBL13879412

Cc1cc(N2C(=O)NC(CC3CCCCC3)C2=O)c(C(F)(F)F)o1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAS2R8 Q9NYW2 2/20 0.42
CCR5 P51681 9/20 0.32
CHRM3 P20309 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
MMP1 P03956 4/20 0.31
MMP9 P14780 3/20 0.31
MMP7 P09237 2/20 0.31
MMP3 P08254 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
ALDH1A1 P00352 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL13879416 0.78 ALDH1A1 (0.33) ALDH1A1
SCHEMBL13879448 0.72 LMNA (0.38) TAS2R8
SCHEMBL13879589 0.72 KDM4E (0.37) TAS2R8ALDH1A1CYP2C19
SCHEMBL13879529 0.68 TAS2R8 (0.47) TAS2R8CCR5MMP1MMP9MMP7
SCHEMBL13879535 0.68 NOX4 (0.40) TAS2R8CCR5POLBALDH1A1
SCHEMBL13879562 0.66 TAS2R8 (0.60) TAS2R8
SCHEMBL2368722 0.66 TAS2R8 (0.61) TAS2R8
SCHEMBL12408226 0.65 MMP1 (0.43) TAS2R8CCR5MMP1MMP9MMP7
SCHEMBL13879572 0.65 TAS2R8 (0.46) TAS2R8MEN1POLBKMT2AMMP1
SCHEMBL13879557 0.65 MMP1 (0.51) TAS2R8CCR5POLBMMP1MMP9

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 TAS2R8 4662/4885CCR5 739/4885CHRM3 4596/4885

“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.