SCHEMBL4335419

SCHEMBL4335419

CC(C)(C)c1cc(C(=O)Cn2ccn(Cc3ccc(C(=O)OC(=O)C(F)(F)F)cc3)c2=N)cc(C(C)(C)C)c1O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2R P25116 10/20 0.48
MAOB P27338 3/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
BCHE P06276 2/20 0.35
MAOA P21397 2/20 0.35
ACHE P22303 2/20 0.35
WDR5 P61964 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALOX5 P09917 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
Trifluoroacetic Acid SCHEMBL4335410 0.86 F2R (0.52) F2RMAOBNPC1RAB9ABCHE
Bromide SCHEMBL4344865 0.85 F2R (0.51) F2RMAOBNPC1RAB9ABCHE
SCHEMBL14346241 0.83 F2R (0.53) F2RMAOBBCHEMAOAACHE
SCHEMBL14346226 0.82 F2R (0.67) F2RMAOBBCHEMAOAACHE
SCHEMBL14346235 0.82 F2R (0.51) F2RMAOBNPC1RAB9ABCHE
Hydrochloric Acid SCHEMBL4352129 0.82 F2R (0.53) F2RMAOBBCHEMAOAACHE
Bromide SCHEMBL4338928 0.81 F2R (0.66) F2RMAOBBCHEMAOAACHE
SCHEMBL4335413 0.81 F2R (0.41) F2RWDR5MEN1KMT2A
SCHEMBL14346245 0.74 F2R (0.53) F2RMAOBBCHEMAOAACHE
SCHEMBL14346346 0.73 F2R (0.43) F2RNPC1RAB9AMEN1KMT2A

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-1391456-B1 2-IMINOIMIDAZOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2009-07-22 EP disclosed
US-7304083-B2 2-iminoimidazole derivatives (2) EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-12-04 US disclosed
US-20050004197-A1 2-iminoimidazole derivatives (2) EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-06 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-20050004197-A1 2-iminoimidazole derivatives (2) H1-2, H1-3, H1-4 F2R 2393/4885MAOB 2255/4885NPC1 4029/4885

“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.