SCHEMBL4292099

SCHEMBL4292099

CCCCCCCCCCCCCCCc1ccc(C(=O)c2ccccc2)c(OC)c1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.74
PPARG P37231 1/20 0.74
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C8 P10632 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2B6 P20813 1/20 0.49
CYP2C19 P33261 1/20 0.49
KAT8 Q9H7Z6 2/20 0.49
KDM4E B2RXH2 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PLK1 P53350 1/20 0.47
ALOX5 P09917 1/20 0.47

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
SCHEMBL10597931 0.90 PPARA (0.62) PPARAPPARGKAT8KDM4EMAPT
SCHEMBL3298521 0.85 PPARA (1.00) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL31065733 0.85 PPARA (1.00) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL20504238 0.85 PPARA (1.00) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL4292104 0.84 PLK1 (0.55) PPARAPPARGMAPTPLK1
SCHEMBL31220575 0.83 PPARA (0.72) PPARAPPARGCYP1A2CYP2C19KAT8
SCHEMBL4285667 0.83 PPARA (0.72) PPARAPPARGCYP1A2CYP2C19KAT8
SCHEMBL28330167 0.83 PPARA (0.72) PPARAPPARGCYP1A2CYP2C19KAT8
SCHEMBL8461758 0.83 PPARA (0.72) PPARAPPARGCYP1A2CYP2C19KAT8
SCHEMBL29363194 0.83 PPARA (0.72) PPARAPPARGCYP1A2CYP2C19KAT8

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-20090068126-A1 Composition for surface photoprotection SOARES ROMEIRO LUIZ ANTONIO 2009-03-12 US disclosed
EP-1812027-A2 COMPOUNDS CAPABLE OF ABSORBING ULTRAVIOLET RADIATION, COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION Universidade Federal Do Rio De Janeiro - UFRJ (BR) 2007-08-01 EP disclosed
WO-2006042391-A2 PHOTOPROTECTIVE PHENOL DERIVATIVES OBTAINED FROM CASHEW NUT-SHELL LIQUID UNIVERSIDADE FEDERAL DO RIO DE JANEIRO-UFRJ (BR) 2006-04-27 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-20090068126-A1 Composition for surface photoprotection S100A10, CD63, S100A9 PPARA 1792/4885PPARG 2023/4885CYP1A2 1983/4885

“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.