SCHEMBL4338978

SCHEMBL4338978

COc1cn(Cc2ccccc2)c(=N)n1CC(=O)c1cc(C(C)(C)C)c(OC(=O)C(F)(F)F)c(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2R P25116 11/20 0.49
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAOB P27338 1/20 0.34
LMNA P02545 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
BCHE P06276 1/20 0.33
MAOA P21397 1/20 0.33
ACHE P22303 1/20 0.33
TNFRSF1A P19438 1/20 0.33
PLA2G2A P14555 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 SCHEMBL4338976 0.88 F2R (0.60) F2RKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL4340442 0.83 F2R (0.50) F2RKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL6748424 0.79 F2R (0.64) F2RKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL6750404 0.78 F2R (0.66) F2RKDM4EMAPTSMN1; SMN2MEN1
Trifluoroacetic Acid SCHEMBL4349250 0.77 F2R (0.62) F2RKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL6746329 0.77 F2R (0.61) F2RKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL14346258 0.77 F2R (0.52) F2RSMN1; SMN2MEN1KMT2AMAOB
SCHEMBL6752883 0.76 F2R (0.56) F2RKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL4335413 0.76 F2R (0.41) F2RKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL4336035 0.76 F2R (0.43) F2RMAOBBCHEMAOAACHE

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 2393/4885KDM4E 2817/4885MAPT 3908/4885

“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.