SCHEMBL7026902

SCHEMBL7026902

O=C1CC2(CCO1)Cn1cc(C(=O)NCc3ccc(Cl)cc3)c(=S)c3cc(CN4CCOCC4)cc(c31)O2

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.51
KCNH2 Q12809 7/20 0.48
RXFP1 Q9HBX9 1/20 0.38
ENPP2 Q13822 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
F2 P00734 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL7031978 0.93 POLA1 (0.59) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6698535 0.92 POLA1 (0.53) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6699326 0.89 POLA1 (0.52) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6696093 0.88 POLA1 (0.51) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6697411 0.88 POLA1 (0.54) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6699084 0.88 POLA1 (0.51) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6698378 0.87 POLA1 (0.50) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6693371 0.85 POLA1 (0.64) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6699282 0.85 POLA1 (0.54) POLA1KCNH2RXFP1ENPP2ALDH1A1
SCHEMBL6697957 0.85 POLA1 (0.53) POLA1KCNH2RXFP1ENPP2ALDH1A1

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
EP-1299395-B1 OXAZINOQUINOLONES USEFUL FOR THE TREATMENT OF VIRAL INFECTIONS UPJOHN CO (US) 2004-09-15 EP claimed