SCHEMBL16996342

SCHEMBL16996342

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)cc21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 4/20 0.32
S1PR5 Q9H228 4/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 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
SCHEMBL25533827 0.96 S1PR4 (0.32) S1PR4S1PR5
SCHEMBL17806821 0.96
SCHEMBL16996026 0.94 S1PR4 (0.32) S1PR4S1PR5
SCHEMBL20623269 0.94
SCHEMBL25533875 0.94 S1PR5 (0.33) S1PR4S1PR5
SCHEMBL17412249 0.93 GPR3 (0.34)
SCHEMBL16996357 0.93 GPR3 (0.34)
SCHEMBL21261110 0.92 PDK2 (0.33)
SCHEMBL16996337 0.91 PIM3 (0.36)
SCHEMBL16996339 0.91 PIM3 (0.36)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150228899-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed
US-20150228899-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed