SCHEMBL27508138

SCHEMBL27508138

CCOc1cc2c(c(F)c1OCC)C(=N)N(CC(=O)c1ccc3c(c1)C(C)(C)CN3CCCC(=O)O)C2

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2R P25116 6/20 0.50
RARB P10826 1/20 0.32
RARG P13631 1/20 0.32
HNF4A P41235 2/20 0.31
RXRA P19793 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 SCHEMBL1730627 0.99 F2R (0.49) F2RRARBRARGHNF4ARXRA
SCHEMBL28744143 0.90 F2R (0.43) F2RRARBRARG
Bromide SCHEMBL1732505 0.89 F2R (0.43) F2RRARBRARG
SCHEMBL27506510 0.89 F2R (0.48) F2RRXRA
Bromide SCHEMBL1732128 0.89 F2R (0.54) F2RRARBHNF4ARXRA
Bromide SCHEMBL1729617 0.88 F2R (0.47) F2RRXRA
Hydrochloric Acid SCHEMBL1732090 0.85 F2R (0.56) F2RRARBRARGHNF4ARXRA
Bromide SCHEMBL5484900 0.83 F2R (0.51) F2RRARBHNF4ARXRA
Bromide SCHEMBL1729637 0.82 F2R (0.52) F2RHNF4ARXRA
SCHEMBL1729623 0.82 F2R (0.52) 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
CN-1243735-C 2-iminopyrrolidine derivatives EISAI CO LTD (JP) 2006-03-01 CN disclosed