SCHEMBL6468614

SCHEMBL6468614

CC(C)CP(=O)(C(=O)c1c(C(C)C)cc(C(C)C)cc1C(C)C)C(=O)c1c(C(C)C)cc(C(C)C)cc1C(C)C

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.53
FABP4 P15090 2/20 0.53
FABP5 Q01469 1/20 0.40
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
GAA P10253 2/20 0.33
SOAT2 O75908 1/20 0.32
MYC P01106 1/20 0.32
SOAT1 P35610 1/20 0.32
MAP2K3 P46734 1/20 0.32
ENPP3 O14638 1/20 0.30
ENPP1 P22413 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL6470369 0.82 FABP3 (0.45) FABP3FABP4FABP5GABRA1GABRB2
SCHEMBL6469474 0.80 FABP3 (0.49) FABP3FABP4FABP5GABRA1GABRB2
SCHEMBL6467158 0.79 FABP3 (0.42) FABP3FABP4FABP5HSD17B10
SCHEMBL6470066 0.78 FABP3 (0.47) FABP3FABP4FABP5GABRA1GABRB2
SCHEMBL6466073 0.77 FABP3 (0.46) FABP3FABP4FABP5
SCHEMBL6469869 0.77 FABP3 (0.46) FABP3FABP4FABP5
SCHEMBL6469476 0.75 FABP3 (0.51) FABP3FABP4FABP5GABRA1GABRB2
SCHEMBL6469292 0.75 FABP3 (0.55) FABP3FABP4FABP5GABRA1GABRB2
SCHEMBL275128 0.72 KMT2A (0.38) KMT2A
SCHEMBL7484474 0.72 FABP4 (0.67) FABP3FABP4FABP5GABRA1GABRB2

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-20050096406-A1 Reactive diluents and alkyd resin coating compositions PRETOT ROGER (CH) 2005-05-05 US disclosed
US-5534559-A UNSATURATED POLYESTERS CIBA-GEIGY CORPORATION (US) 1996-07-09 US disclosed