SCHEMBL4838647

SCHEMBL4838647

CC(C)c1ccccc1P([N]P(c1ccccc1C(C)C)c1ccccc1C(C)C)c1ccccc1C(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.43
GABRB2 P47870 2/20 0.43
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
FAAH O00519 2/20 0.39
LMNA P02545 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
TSHR P16473 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
GABRB1 P18505 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2C P28335 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
HTR2B P41595 1/20 0.39
GABRA2 P47869 1/20 0.39

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
SCHEMBL3769639 0.78 GABRA1 (0.48) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL10154126 0.76 GABRA1 (0.46) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL2154332 0.74 GABRA1 (0.44) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL2154216 0.74 GABRA1 (0.44) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL30884226 0.74 GABRA1 (0.44) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL4838649 0.73 GABRA1 (0.43) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL10024962 0.71 CYP3A4 (0.46) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL15275536 0.71 GABRA1 (0.41) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL66162 0.71 GABRA1 (0.63) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL29429205 0.71 GABRA1 (0.63) GABRA1GABRB2GABRG2GABRB3FAAH

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