SCHEMBL14414971

SCHEMBL14414971

CCOC(=O)C(C)(C)Oc1c(C)cc(CN(Cc2ncco2)Cc2ncc(-c3ccccc3)o2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.46
PPARG P37231 10/20 0.46
FFAR1 O14842 1/20 0.36
PPARD Q03181 4/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
NOTUM Q6P988 1/20 0.34
GPR119 Q8TDV5 1/20 0.34
CYP3A4 P08684 1/20 0.34
GRM2 Q14416 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
SCHEMBL14414972 0.92 PPARA (0.55) PPARAPPARGFFAR1PPARDCYP1A2
SCHEMBL5484176 0.91 PPARA (0.44) PPARAPPARGFFAR1PPARDCYP1A2
SCHEMBL5480236 0.88 PPARA (0.42) PPARAPPARGFFAR1PPARDCYP1A2
SCHEMBL14414992 0.87 PPARA (0.54) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL5476286 0.87 PPARA (0.50) PPARAPPARG
SCHEMBL5478122 0.85 PPARG (0.66) PPARAPPARGPPARD
SCHEMBL5472024 0.82 PPARA (0.39) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL5472695 0.82 PPARA (0.38) PPARAPPARGFFAR1PPARDCYP1A2
SCHEMBL5473393 0.82 PPARA (0.53) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL5484736 0.81 PPARG (0.57) PPARAPPARGPPARD

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
US-20070208021-A1 Phenoxyacetic Acid Derivatives and Drug Comprising The Same DAIICHI PHARMACEUTICAL CO., LTD. 2007-09-06 US disclosed
US-20070208021-A1 Phenoxyacetic Acid Derivatives and Drug Comprising The Same DAIICHI PHARMACEUTICAL CO., LTD. 2007-09-06 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-20070208021-A1 Phenoxyacetic Acid Derivatives and Drug Comprising The Same PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885FFAR1 11/4885

“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.