SCHEMBL5884261

SCHEMBL5884261

CON=Cc1ccc(OCCC2CCN(c3nnc(C)s3)CC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.37
PPARD Q03181 3/20 0.37
GAA P10253 1/20 0.35
PPARA Q07869 2/20 0.35
HPGD P15428 3/20 0.35
RXFP1 Q9HBX9 2/20 0.35
HRH3 Q9Y5N1 4/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.33
TEAD1 P28347 1/20 0.33
TEAD3 Q99594 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL5884212 0.90 RXFP1 (0.37) PPARGPPARDPPARAHPGDRXFP1
SCHEMBL5884304 0.87 HTT (0.39) PPARGPPARDPPARAHPGDHRH3
SCHEMBL5884362 0.82 NR1I2 (0.38) GAAHPGDMAPTTEAD1TEAD3
SCHEMBL5884324 0.81 PPARG (0.46) PPARGPPARDGAAPPARAMAPT
SCHEMBL5884475 0.78 TDP1 (0.41) GAAMAPTTEAD1TEAD3SMN1; SMN2
SCHEMBL5883844 0.78 MEN1 (0.38) PPARGPPARDHPGDRXFP1MAPT
SCHEMBL5884268 0.78 MEN1 (0.43) MEN1SMN1; SMN2
SCHEMBL5884624 0.77 GPR119 (0.44) GAA
SCHEMBL5884356 0.77 HRH3 (0.38) GAAHPGDHRH3MAPT
SCHEMBL5884691 0.77 RAB9A (0.41) PPARGPPARDGAAPPARAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7078403-B1 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2006-07-18 US claimed