SCHEMBL2468177

SCHEMBL2468177

Cc1ccccc1-c1cccc(Nc2ccc3c(c2)C2(c4cc(Nc5cccc(-c6ccccc6C)c5)ccc4-3)c3cc(Nc4cccc(-c5ccccc5C)c4)ccc3-c3ccc(Nc4cccc(-c5ccccc5C)c4)cc32)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.48
▸ PDK2 Q15119 3/20 0.43
▸ NR1H4 Q96RI1 1/20 0.41
▸ HTR7 P34969 3/20 0.40
▸ FFAR1 O14842 2/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ HTR1A P08908 1/20 0.37
▸ PLA2G7 Q13093 1/20 0.36
▸ CAMK1D Q8IU85 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ AR P10275 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35

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
SCHEMBL18803249 0.87 CNR1 (0.45) CNR1PDK2NR1H4HTR7FFAR1
SCHEMBL22356061 0.86 CNR1 (0.55) CNR1NR1H4HTR7FFAR1FFAR4
SCHEMBL18803252 0.84 PDK2 (0.43) CNR1PDK2NR1H4HTR7FFAR1
SCHEMBL30232756 0.83 CNR1 (0.54) CNR1NR1H4HTR7FFAR1FFAR4
SCHEMBL130523 0.83 CNR1 (0.54) CNR1NR1H4HTR7FFAR1FFAR4
SCHEMBL29518615 0.82 PDK2 (0.51) CNR1PDK2ALDH1A1MEN1AR
SCHEMBL17886978 0.82 PDK2 (0.51) CNR1PDK2ALDH1A1MEN1AR
SCHEMBL5845967 0.79 CNR1 (0.50) CNR1NR1H4HTR7FFAR1FFAR4
SCHEMBL14520996 0.79 NPSR1 (0.56) PDK2NPSR1ALDH1A1MEN1MAPT
SCHEMBL807851 0.79 ALDH1A1 (0.42) PDK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2220702-B1 DEVICE COMPRISING AN ORGANIC COMPONENT AND AN ENCAPSULATION LAYER WITH A MOISTURE-REACTIVE MATERIAL COMMISSARIAT ENERGIE ATOMIQUE (FR) 2011-09-28 — — EP claimed
US-8227800-B2 Device comprising an organic component and an encapsulation layer with a moisture-reactive material COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2012-07-24 — — US disclosed
EP-2220702-B1 DEVICE COMPRISING AN ORGANIC COMPONENT AND AN ENCAPSULATION LAYER WITH A MOISTURE-REACTIVE MATERIAL COMMISSARIAT ENERGIE ATOMIQUE (FR) 2011-09-28 — — EP disclosed
US-20100276818-A1 DEVICE COMPRISING AN ORGANIC COMPONENT AND AN ENCAPSULATION LAYER WITH A MOISTURE-REACTIVE MATERIAL COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2010-11-04 — — US disclosed
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