SCHEMBL17826892

SCHEMBL17826892

Cn1c2ccccc2c2ccc(-c3ccc4c(c3)c3ccccc3n4N)cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.52
RXRB P28702 1/20 0.52
GPR3 P46089 1/20 0.52
KDM4E B2RXH2 4/20 0.49
L3MBTL1 Q9Y468 4/20 0.49
MAPT P10636 4/20 0.49
HPGD P15428 4/20 0.49
ALDH1A1 P00352 3/20 0.49
HSD17B10 Q99714 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HTT P42858 1/20 0.49
PABPC1 P11940 1/20 0.48
KIF11 P52732 1/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
LMNA P02545 1/20 0.44

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
SCHEMBL19910442 0.95 GPR3 (0.57) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL20977611 0.93 GPR3 (0.55) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL10447279 0.92 GPR3 (0.61) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL21524767 0.88 GPR3 (0.57) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL20842551 0.87 RXRA (0.62) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL17809441 0.87 GPR3 (0.55) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL19986206 0.87 RXRA (0.62) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL22192128 0.87 RXRA (0.62) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL12419782 0.86 GPR3 (0.64) RXRARXRBGPR3KDM4EL3MBTL1
SCHEMBL12419781 0.86 GPR3 (0.64) RXRARXRBGPR3KDM4EL3MBTL1

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-3032606-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE Samsung SDI Co., Ltd. (KR) 2016-06-15 EP disclosed