SCHEMBL662672

SCHEMBL662672

CCCCc1nc(C)n(-c2ncc(OC)cn2)c(=O)c1Cc1cc(CCC)c(OC(C(=O)OC)c2ccc(Cl)cc2)c(CCC)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.36
PPARA Q07869 8/20 0.36
FPR1 P21462 1/20 0.34
P2RX3 P56373 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
APLNR P35414 1/20 0.32

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
SCHEMBL661631 0.94 PPARG (0.42) PPARGPPARA
SCHEMBL659869 0.88 PPARG (0.45) PPARGPPARA
SCHEMBL667422 0.86 PPARG (0.39) PPARGPPARA
SCHEMBL660779 0.85 PPARG (0.37) PPARGPPARA
SCHEMBL667684 0.84 PPARG (0.37) PPARGPPARA
SCHEMBL660790 0.82 PPARG (0.44) PPARGPPARA
SCHEMBL661383 0.81 PPARG (0.43) PPARGPPARA
SCHEMBL663011 0.80 APLNR (0.40) APLNR
SCHEMBL660874 0.80 PPARG (0.45) PPARGPPARA
SCHEMBL660948 0.80 PPARG (0.41) PPARGPPARA

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 1 patent. 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 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 1/4885FPR1 520/4885

“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.