SCHEMBL5484176

SCHEMBL5484176

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.44
PPARG P37231 12/20 0.44
PPARD Q03181 7/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
FFAR1 O14842 1/20 0.36
NOTUM Q6P988 1/20 0.35
NPC1 O15118 1/20 0.33
CLK1 P49759 1/20 0.33
RAB9A P51151 1/20 0.33
GFER P55789 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33

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
SCHEMBL5473393 0.91 PPARA (0.53) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL14414971 0.91 PPARA (0.46) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL5480236 0.89 PPARA (0.42) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL5482121 0.88 PPARA (0.43) PPARAPPARG
SCHEMBL5472695 0.84 PPARA (0.38) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL14414972 0.82 PPARA (0.55) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL5482034 0.81 PPARA (0.49) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL14419791 0.79 PPARA (0.49) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL5475620 0.79 PPARA (0.51) PPARAPPARGPPARDCYP1A2CYP2C9
SCHEMBL14414992 0.78 PPARA (0.54) PPARAPPARGPPARDCYP1A2CYP2C9

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 4 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
US-20070208021-A1 Phenoxyacetic Acid Derivatives and Drug Comprising The Same DAIICHI PHARMACEUTICAL CO., LTD. 2007-09-06 US disclosed
EP-1731513-A1 PHENOXYACETIC ACID DERIVATIVE AND MEDICINE CONTAINING THE SAME DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-13 EP 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 2/4885PPARD 3/4885

“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.