SCHEMBL4682118

SCHEMBL4682118

C=C(C)n1nc(-c2ccc(OC(F)(F)F)cc2)cc1C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
POLB P06746 4/20 0.45
TDP1 Q9NUW8 2/20 0.45
APEX1 P27695 1/20 0.45
RECQL P46063 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ELANE P08246 2/20 0.44
FAAH O00519 4/20 0.43
ALDH1A1 P00352 1/20 0.43
ADORA3 P0DMS8 1/20 0.42
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
LMNA P02545 2/20 0.41
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL2423765 0.84 FAAH (0.59) MAPTPOLBTDP1APEX1RECQL
SCHEMBL718990 0.83 FAAH (0.59) MAPTPOLBTDP1APEX1RECQL
SCHEMBL2423857 0.81 MAPT (0.48) MAPTPOLBTDP1APEX1RECQL
SCHEMBL2428624 0.81 MAPT (0.56) MAPTPOLBTDP1APEX1RECQL
SCHEMBL14290010 0.81 MAPT (0.53) MAPTPOLBTDP1APEX1RECQL
SCHEMBL4685132 0.78 MAPT (0.42) MAPTRECQLL3MBTL1ADORA3KDM4E
SCHEMBL4679879 0.78 MAPT (0.53) MAPTPOLBTDP1APEX1RECQL
SCHEMBL4682703 0.78 MAPT (0.79) MAPTPOLBTDP1APEX1RECQL
SCHEMBL4677883 0.77 MAPT (0.41) MAPTRECQLL3MBTL1ADORA3KDM4E
SCHEMBL3395570 0.73 MAPT (0.47) MAPTRECQLL3MBTL1ADORA3KDM4E

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 3 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-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 4374/4885POLB 2197/4885TDP1 2079/4885

“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.