SCHEMBL4682178

SCHEMBL4682178

Cn1nc(-c2ccc(C(F)(F)F)cc2)cc1NCc1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 5/20 0.51
MAPT P10636 5/20 0.45
TP53 P04637 5/20 0.45
ADORA2A P29274 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
PTGS2 P35354 2/20 0.44
PTGS1 P23219 1/20 0.44
GAA P10253 2/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
VNN1 O95497 1/20 0.43
PPARA Q07869 1/20 0.42
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.41
ATM Q13315 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 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
SCHEMBL4683098 0.87 ACP1 (0.56) MAPTTP53GAASMN1; SMN2
SCHEMBL4739698 0.82 F2 (0.45) F2MAPTTP53PTGS2GAA
SCHEMBL5306328 0.82 F2 (0.47) F2MAPTTP53ADORA2ATDP1
SCHEMBL4678759 0.81 MAPT (0.44) F2MAPTTP53GAAPOLB
SCHEMBL5399665 0.78 MAPT (0.48) MAPTTP53GAAKDM4EHSD17B10
SCHEMBL3609826 0.74 KDM4E (0.47) F2MAPTTP53GAAPOLB
SCHEMBL10119766 0.73 MAPT (0.57) F2MAPTTP53POLBSMN1; SMN2
SCHEMBL5303639 0.72 LMNA (0.44) F2MAPTTP53POLBSMN1; SMN2
SCHEMBL16934905 0.71 PI4KB (0.65) MAPTTDP1KDM4EMEN1HTT
SCHEMBL5306913 0.71 CDK2 (0.40) MAPTTDP1GAAPOLBKDM4E

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 6 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
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 F2 2218/4885MAPT 4374/4885TP53 1707/4885

“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.