SCHEMBL1730143

SCHEMBL1730143

CCOc1cc2c(nc1C(=O)NC)C(=N)N(CC(=O)c1cc(N3CCCC3)c(OCCCCCC(=O)O)c(C(C)(C)C)c1)C2

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2R P25116 14/20 0.48
RARA P10276 2/20 0.31
RARB P10826 2/20 0.31
RARG P13631 2/20 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 SCHEMBL5488082 0.99 F2R (0.48) F2RRARARARBRARG
Bromide SCHEMBL1730497 0.99 F2R (0.48) F2RRARARARBRARG
Bromide SCHEMBL1730006 0.97 F2R (0.49) F2RRARARARBRARG
Hydrochloric Acid SCHEMBL1729660 0.92 F2R (0.48) F2R
Bromide SCHEMBL6545059 0.91 F2R (0.57) F2R
Hydrochloric Acid SCHEMBL5488899 0.91 F2R (0.52) F2R
Bromide SCHEMBL1730360 0.90 F2R (0.48) F2R
Hydrochloric Acid SCHEMBL1729300 0.90 F2R (0.49) F2R
Bromide SCHEMBL1732041 0.90 F2R (0.48) F2R
Bromide SCHEMBL1730226 0.89 F2R (0.44) F2R

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 1 patent. 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