SCHEMBL1729771

SCHEMBL1729771

CCOc1cc2c(c(F)c1OCC)C(=N)N(CC(=O)c1cc(N3CCCCC3=O)c(OC)c(C(C)(C)C)c1)C2

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2R P25116 16/20 0.73
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
RARG P13631 1/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 1/20 0.31

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
Bromide SCHEMBL5483858 0.99 F2R (0.74) F2RRARARARBRARGLMNA
Bromide SCHEMBL1729585 0.97 F2R (0.75) F2RRARARARBRARGLMNA
Bromide SCHEMBL1732653 0.91 F2R (0.61) F2RRARARARBRARGLMNA
SCHEMBL14449152 0.90 F2R (0.87) F2RMAPT
Bromide SCHEMBL1730235 0.89 F2R (0.87) F2RMAPT
SCHEMBL13144389 0.89 F2R (0.86) F2RMAPT
Bromide SCHEMBL1732057 0.89 F2R (0.62) F2RRARARARBRARGLMNA
Trifluoroacetic Acid SCHEMBL1729653 0.88 F2R (0.62) F2RRARARARBRARG
SCHEMBL1732773 0.88 F2R (0.84) F2RLMNAMAPT
Bromide SCHEMBL1728988 0.87 F2R (0.84) F2RLMNAMAPT

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 2 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
EP-1391451-A1 2-IMINOPYRROLIDINE DERIVATES Eisai Co., Ltd. (JP) 2004-02-25 EP disclosed