SCHEMBL5283326

SCHEMBL5283326

CCCCc1cc(C(=O)Oc2c(F)c(F)c(F)c(F)c2F)on1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.41
MAPK14 Q16539 1/20 0.39
SMPD1 P17405 1/20 0.38
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 4/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
XBP1 P17861 1/20 0.33
KMT2A Q03164 1/20 0.33
DDX3X O00571 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
SCHEMBL5298423 0.92 PPARA (0.35) PPARASMPD1NPC1LMNAMAPK1
SCHEMBL5286375 0.86 EPHX2 (0.35) SMPD1NPC1LMNATP53TSHR
SCHEMBL5283038 0.81 PPARA (0.46) PPARAMAPK14SMPD1NPC1LMNA
SCHEMBL5287519 0.80 RAB9A (0.34) PPARANPC1LMNATSHRMAPK1
SCHEMBL5285680 0.76 PPARA (0.52) PPARAMAPK14SMPD1LMNATSHR
SCHEMBL5289527 0.73 SCD (0.31) SMPD1NPC1LMNATP53RAB9A
SCHEMBL5966730 0.72 SMN1; SMN2 (0.41) PPARASMPD1NPC1TSHRMAPK1
SCHEMBL5966687 0.71 SMN1; SMN2 (0.40) MAPK14LMNAMAPTALDH1A1
SCHEMBL5966739 0.71 ALDH1A1 (0.40) MAPK14NPC1TSHRRAB9AALDH1A1
SCHEMBL7500491 0.71 PPARA (0.61) PPARASMPD1MAPTMEN1ALDH1A1

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
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 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-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 PPARA 2245/4885MAPK14 2521/4885SMPD1 46/4885

“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.