SCHEMBL14900779

SCHEMBL14900779

Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6C)ccc3n4C(C)(C)C)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.53
▸ KDM4E B2RXH2 4/20 0.50
▸ HPGD P15428 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ KIF11 P52732 1/20 0.45
▸ NPY5R Q15761 1/20 0.43
▸ RXRA P19793 1/20 0.43
▸ RXRB P28702 1/20 0.43
▸ PABPC1 P11940 1/20 0.42
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL24816197 0.88 TSPO (0.48) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL10447275 0.88 GPR3 (0.70) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL10331500 0.88 GPR3 (0.70) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL17809439 0.86 GPR3 (0.67) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL13791925 0.85 TSPO (0.40) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL13762046 0.85 TSPO (0.40) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL23634609 0.85 GPR3 (0.55) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL26057874 0.84 GPR3 (0.47) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL15196353 0.84 KIF11 (0.43) GPR3KDM4EHPGDMAPTL3MBTL1
SCHEMBL12419782 0.84 GPR3 (0.64) GPR3KDM4EHPGDMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595208-A1 LIGHT EMITTING ELEMENT Toray Industries, Inc. (JP) 2013-05-22 — — EP disclosed
US-20130105787-A1 LIGHT EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2013-05-02 — — US disclosed
US-20130105787-A1 LIGHT EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2013-05-02 — — US disclosed
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