SCHEMBL6283928

SCHEMBL6283928

Cn1ccc(-c2ccc3c(c2)COCCN3)c1C#N

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.35
BRD4 O60885 1/20 0.33
PGR P06401 2/20 0.32
OTUD7B Q6GQQ9 3/20 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
SCHEMBL4901931 0.77 PGR (0.43) PGR
SCHEMBL6279895 0.73 PGR (0.43) PGROTUD7B
SCHEMBL6282794 0.69 LMNA (0.34) PGR
SCHEMBL11436661 0.66 GAA (0.50)
SCHEMBL28349524 0.65 ALDH1A1 (0.42)
SCHEMBL7481521 0.64 PGR (0.57) PGR
SCHEMBL25429798 0.63 FABP6 (0.38)
SCHEMBL20804966 0.63 AHR (0.40)
SCHEMBL28350046 0.63 KDM4E (0.41) GRM2
SCHEMBL28882198 0.63 ALDH1A1 (0.57) GRM2BRD4

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
WO-2005095366-A1 7-ARYL 1,5-DIHYDRO-4,1-BENZOXAZEPIN-2(3H)-ONE DERIVATIVES AND THEIR USE AS PROGESTERONE RECEPTOR MODULATORS WYETH (US) 2005-10-13 WO disclosed