SCHEMBL1729016

SCHEMBL1729016

CCC(Oc1ccc2c(c1)C(=N)N(CC(=O)c1cc(C(C)(C)C)c(OC(=O)C(F)(F)F)c(C(C)(C)C)c1)C2)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
F2R P25116 7/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.32
PPARG P37231 1/20 0.30

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 SCHEMBL1729013 0.89 KDM4E (0.40) KDM4EMAPTRAB9ANPC1F2R
SCHEMBL1729019 0.84 KDM4E (0.39) KDM4EMAPTRAB9ANPC1F2R
SCHEMBL1731158 0.84 KDM4E (0.40) KDM4EMAPTRAB9ANPC1F2R
SCHEMBL1731326 0.84 KDM4E (0.38) KDM4EMAPTRAB9ANPC1F2R
SCHEMBL1729029 0.80 F2R (0.40) KDM4EMAPTRAB9ANPC1F2R
SCHEMBL1731018 0.79 F2R (0.38) KDM4EMAPTRAB9ANPC1F2R
SCHEMBL1730570 0.79 F2R (0.46) KDM4EMAPTRAB9ANPC1F2R
SCHEMBL1729261 0.79 F2R (0.49) KDM4EMAPTRAB9ANPC1F2R
SCHEMBL1731715 0.77 KDM4E (0.42) KDM4EMAPTRAB9ANPC1F2R
Trifluoroacetic Acid SCHEMBL1731712 0.76 KDM4E (0.41) KDM4EMAPTRAB9ANPC1F2R

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-1391451-B1 2-IMINOPYRROLIDINE DERIVATES EISAI R&D MAN CO LTD (JP) 2011-11-23 EP disclosed
US-7244730-B2 2-iminopyrrolidine derivatives EISAI CO., LTD (JP) 2007-07-17 US disclosed
US-20050245592-A1 2-Iminopyrrolidine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-11-03 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-20050245592-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 KDM4E 3161/4885MAPT 3483/4885RAB9A 429/4885

“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.