SCHEMBL3842292

SCHEMBL3842292

CCCCCCCn1nc(OCc2ccc(OC(C)(CCC)C(=O)O)cc2)c(=O)n(C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.39
PPARA Q07869 9/20 0.39
CNR1 P21554 2/20 0.39
ACHE P22303 2/20 0.39
CNR2 P34972 2/20 0.39
HTR2C P28335 1/20 0.39
SLC6A4 P31645 1/20 0.39
PPARD Q03181 5/20 0.38
S1PR4 O95977 2/20 0.36
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
S1PR5 Q9H228 1/20 0.36
PLA2G4B P0C869 1/20 0.35
SMPD1 P17405 1/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL3842005 0.91 PPARG (0.42) PPARGPPARAPPARDS1PR4S1PR1
SCHEMBL3847191 0.91 PPARG (0.42) PPARGPPARAPPARDS1PR4S1PR1
SCHEMBL3842859 0.91 PPARA (0.42) PPARGPPARAPPARDS1PR4S1PR1
SCHEMBL3841197 0.90 PPARA (0.48) PPARGPPARAPPARD
SCHEMBL3849916 0.87 PPARA (0.41) PPARGPPARACNR1ACHECNR2
SCHEMBL3848677 0.86 PPARG (0.41) PPARGPPARACNR1ACHECNR2
SCHEMBL3846291 0.84 PLA2G4B (0.40) PPARGPPARAPLA2G4BSMPD1KMT2A
SCHEMBL3292871 0.84 PPARA (0.44) PPARGPPARACNR1ACHECNR2
SCHEMBL3845248 0.83 PLA2G4B (0.40) PPARGPPARAPLA2G4BSMPD1KMT2A
SCHEMBL3844865 0.83 PPARA (0.48) PPARGPPARACNR1CNR2PPARD

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
EP-1856065-B1 1,2,4-TRIAZINE DERIVATIVES, PREPARATION AND USE THEREOF IN HUMAN THERAPY PF MEDICAMENT (FR) 2009-11-11 EP claimed
US-20080167313-A1 1,2,4-Triazine Derivatives, Preparation and Use Thereof in Human Therapy PIERRE FABRE MEDICAMENT (FR) 2008-07-10 US claimed

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-20080167313-A1 1,2,4-Triazine Derivatives, Preparation and Use Thereof in Human Therapy CBR3, NOX3, RTN3 PPARG 2530/4885PPARA 3384/4885CNR1 119/4885

“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.