SCHEMBL4832909

SCHEMBL4832909

CCc1ccccc1P(NP(c1ccccc1CC)c1ccccc1CC)c1ccccc1CC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.39
GABRB2 P47870 3/20 0.39
MGLL Q99685 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CLCN2 P51788 1/20 0.33

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
SCHEMBL29790848 0.78 GABRA1 (0.44) GABRA1GABRB2MGLLHDAC3HDAC4
SCHEMBL2340745 0.78 GABRA1 (0.44) GABRA1GABRB2MGLLHDAC3HDAC4
SCHEMBL4839685 0.77 RIPK1 (0.42) MEN1LMNAKMT2A
SCHEMBL20873227 0.76 GABRA1 (0.42) GABRA1GABRB2MGLLHDAC3HDAC4
SCHEMBL1950129 0.76 GABRA1 (0.42) GABRA1GABRB2MGLLHDAC3HDAC4
SCHEMBL28530344 0.74 GABRA1 (0.41) GABRA1GABRB2MGLLHDAC3HDAC4
SCHEMBL2154397 0.74 GABRA1 (0.41) GABRA1GABRB2MGLLHDAC3HDAC4
SCHEMBL4832903 0.73 GABRA1 (0.39) GABRA1GABRB2MGLLHDAC3HDAC4
SCHEMBL1727172 0.71 CYP3A4 (0.46) GABRA1GABRB2MGLLMAPTGAA
Propane SCHEMBL2244009 0.71 PSIP1 (0.37) HDAC3HDAC1HDAC2ALDH1A1GAA

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-7378537-B2 Olefin oligomerization catalysts and methods of using same CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2008-05-27 US disclosed
US-20080027188-A1 OLEFIN OLIGOMERIZATION CATALYSTS AND METHODS OF USING SAME CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2008-01-31 US disclosed