SCHEMBL4679879

SCHEMBL4679879

CCOC(=O)c1cc(-c2ccc(OC(F)(F)F)cc2)nn1CCC(C)C

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
TDP1 Q9NUW8 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 2/20 0.50
FAAH O00519 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
APEX1 P27695 1/20 0.46
RECQL P46063 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
RAB9A P51151 1/20 0.43
SLC5A1 P13866 1/20 0.43
SLC5A2 P31639 1/20 0.43
ALDH1A1 P00352 3/20 0.42
GCGR P47871 5/20 0.42
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
DAGLA Q9Y4D2 1/20 0.40
ELANE P08246 1/20 0.40

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
SCHEMBL14290104 0.89 MAPT (0.40) MAPTTDP1SMN1; SMN2POLBFAAH
SCHEMBL718990 0.87 FAAH (0.59) MAPTTDP1SMN1; SMN2POLBFAAH
SCHEMBL2428624 0.85 MAPT (0.56) MAPTTDP1SMN1; SMN2POLBFAAH
SCHEMBL2423765 0.83 FAAH (0.59) MAPTTDP1SMN1; SMN2POLBFAAH
SCHEMBL14290010 0.82 MAPT (0.53) MAPTTDP1SMN1; SMN2POLBFAAH
SCHEMBL4682703 0.81 MAPT (0.79) MAPTTDP1SMN1; SMN2POLBL3MBTL1
SCHEMBL14215640 0.81 MAPT (0.48) MAPTTDP1SMN1; SMN2POLBFAAH
SCHEMBL2423857 0.81 MAPT (0.48) MAPTTDP1SMN1; SMN2POLBFAAH
Hydrochloric Acid SCHEMBL4717037 0.80 MAPT (0.47) MAPTTDP1SMN1; SMN2POLBFAAH
SCHEMBL4677624 0.79 GCGR (0.41) MAPTL3MBTL1RECQLGCGRDAGLA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513796-B1 PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORP (US) 2008-02-13 EP disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-20050222424-A1 Phenyloxyalkanonic acid derivatives as hppar activators SMITHKLINE BEECHAM CORPORATION 2005-10-06 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-20050222424-A1 Phenyloxyalkanonic acid derivatives as hppar activators CEL, HPN, LIPA MAPT 4374/4885TDP1 2079/4885SMN1; SMN2 3646/4885

“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.