SCHEMBL28022290

SCHEMBL28022290

O=C(c1ccc(Cc2ccc(C(=O)N3CC3)cc2)cc1)N1CC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
HPGD P15428 2/20 0.59
HRH3 Q9Y5N1 4/20 0.54
GPR183 P32249 1/20 0.53
PKM P14618 1/20 0.52
POLB P06746 1/20 0.52

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
SCHEMBL8747189 0.86 HPGD (0.76) ALDH1A1HPGDPKMPOLB
SCHEMBL4689643 0.84 HPGD (0.61) ALDH1A1HPGD
SCHEMBL693330 0.81 SIGMAR1 (0.73) ALDH1A1HPGD
SCHEMBL12736237 0.80 HSD17B10 (0.63) ALDH1A1HPGDHRH3POLB
SCHEMBL3917660 0.80 KDM4E (0.68) ALDH1A1HRH3POLB
SCHEMBL693648 0.79 KDM4E (0.56) ALDH1A1HRH3POLB
SCHEMBL4689720 0.79 KMT2A (0.68) ALDH1A1HPGDPKMPOLB
SCHEMBL694865 0.78 KDM4E (0.51) ALDH1A1HRH3POLB
SCHEMBL10076240 0.77 SLC6A7 (0.58) ALDH1A1HPGDHRH3
SCHEMBL3754883 0.77 HRH3 (0.66) HPGDHRH3POLB

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-104854646-A Display device LG CHEMICAL LTD 2015-08-19 CN disclosed