SCHEMBL4283592

SCHEMBL4283592

O=CC=Cc1ccc(Sc2ccc(F)cc2)cc1C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ITGAL P20701 1/20 0.35
APP P05067 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
AR P10275 2/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PGR P06401 1/20 0.32

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
SCHEMBL4283586 1.00 ITGAL (0.35) ITGALAPPMEN1KMT2ACYP1A2
SCHEMBL13879675 0.74 ITGAL (0.40) ITGALMEN1KMT2ACYP1A2CYP2C9
SCHEMBL13879673 0.73 ITGAL (0.54) ITGALMAPTALDH1A1
SCHEMBL13879679 0.73 SMN1; SMN2 (0.41) ITGALMEN1KMT2AMAPTALDH1A1
SCHEMBL13879684 0.72 MAOB (0.39) ITGALMEN1KMT2ACYP1A2CYP2C9
SCHEMBL28240259 0.72 TDP1 (0.40) APPCYP1A2CYP2C19MAPTHTT
SCHEMBL13879687 0.71 MAOB (0.40) ITGALMEN1KMT2ACYP1A2CYP2C19
SCHEMBL13879682 0.71 ITGAL (0.56) ITGALALDH1A1
SCHEMBL13879669 0.71 ITGAL (0.54) ITGAL
SCHEMBL30584115 0.68 NFKB1 (0.59) MEN1KMT2AMAPTALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 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-20090099186-A1 INHIBITORS OF VIRAL REPLICATION EIF2AK2, HAVCR2, RTF2 ITGAL 4495/4885APP 4226/4885MEN1 4395/4885

“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.