SCHEMBL660829

SCHEMBL660829

CCCCc1nc(C)n(-c2ccccn2)c(=O)c1Cc1cc(CCC)c(OC(c2ccccc2)c2noc(=O)[nH]2)c(CCC)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.31
PPARA Q07869 2/20 0.31
KDM4E B2RXH2 1/20 0.31
PLA2G10 O15496 1/20 0.31
PLA2G1B P04054 1/20 0.31
PLA2G2A P14555 1/20 0.31
PLA2G5 P39877 1/20 0.31
CYBB P04839 1/20 0.31
NOX4 Q9NPH5 1/20 0.31
NOX1 Q9Y5S8 1/20 0.31
SLC33A1 O00400 1/20 0.30

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
SCHEMBL660932 0.87 KDM4E (0.32) KDM4ECYBBNOX4NOX1
SCHEMBL660214 0.82 PPARG (0.46) PPARGPPARA
SCHEMBL666225 0.81 PPARG (0.41) PPARGPPARA
SCHEMBL667431 0.81 PPARG (0.39) PPARGPPARA
SCHEMBL660630 0.80 PPARG (0.36) PPARGPPARA
SCHEMBL659491 0.79 CCR2 (0.34)
SCHEMBL661118 0.79 PPARG (0.48) PPARGPPARA
SCHEMBL661239 0.78 PPARG (0.40) PPARGPPARA
SCHEMBL662884 0.78 EDNRB (0.39) PPARGPPARA
SCHEMBL660591 0.78 DPP4 (0.35) KDM4ECYBBNOX4NOX1

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-20120046308-A1 NOVEL ALPHA-PHENOXYBENZENEACETIC ACID DERIVATIVE AND PHARMACEUTICAL PREPARATION COMPRISING SAME KOWA COMPANY, LTD. (JP) 2012-02-23 US claimed
US-20120046308-A1 NOVEL ALPHA-PHENOXYBENZENEACETIC ACID DERIVATIVE AND PHARMACEUTICAL PREPARATION COMPRISING SAME KOWA COMPANY, LTD. (JP) 2012-02-23 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-20120046308-A1 NOVEL ALPHA-PHENOXYBENZENEACETIC ACID DERIVATIVE AND PHARMACEUTICAL PREPARATION COMPRISING SAME PPARA, PPARG, PPARD PPARG 2/4885PPARA 1/4885KDM4E 3100/4885

“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.