SCHEMBL6470341

SCHEMBL6470341

CCCCP(=O)(C(=O)c1c(CCC)cc(CCC)cc1CCC)C(=O)c1c(CCC)cc(CCC)cc1CCC

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.38
PTPN11 Q06124 2/20 0.38
GPR84 Q9NQS5 2/20 0.36
CA12 O43570 1/20 0.33
TSHR P16473 2/20 0.33
PLK1 P53350 1/20 0.33
PTGS2 P35354 3/20 0.33
CYP3A4 P08684 1/20 0.33
CETP P11597 2/20 0.32
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL6470130 0.84 TSHR (0.34) GPR84TSHRCETP
SCHEMBL6469681 0.80 PTPN1 (0.37) PTPN1PTPN11CA12PLK1HPGD
SCHEMBL6470043 0.79 CETP (0.38) GPR84CETP
SCHEMBL6466115 0.78 CETP (0.40) CETP
SCHEMBL6467881 0.78 CETP (0.40) CETP
SCHEMBL6470386 0.78 CETP (0.40) CETP
SCHEMBL6470195 0.76 TSHR (0.45) TSHRCETPHTT
SCHEMBL2497195 0.76 HPGD (0.41) TSHRHPGD
SCHEMBL6465353 0.75 NPC1 (0.37) GPR84PLK1PTGS2CYP3A4NPC1
SCHEMBL6470378 0.73 MEN1 (0.34) PLK1

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