SCHEMBL8053290

SCHEMBL8053290

Nc1ncnc2c1ncn2CCC1CCC(COCP(=O)(O)O)CC1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.67
SLC22A6 Q4U2R8 2/20 0.67
CYP3A4 P08684 1/20 0.53
ADCY5 O95622 1/20 0.49
ENPP1 P22413 1/20 0.48
ADORA2A P29274 3/20 0.48
ADORA1 P30542 2/20 0.48
ABCB11 O95342 1/20 0.47
POLA1 P09884 1/20 0.47
POLG P54098 1/20 0.47
FAP Q12884 1/20 0.47
AHCY P23526 1/20 0.46
ADORA2B P29275 1/20 0.45
RNASEL Q05823 3/20 0.44
TRPM2 O94759 1/20 0.44

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
SCHEMBL2352757 0.81 FGFR1 (0.86) FGFR1SLC22A6CYP3A4ADCY5ENPP1
Adefovir SCHEMBL29365535 0.81 FGFR1 (1.00) FGFR1SLC22A6CYP3A4ADCY5ENPP1
Adefovir SCHEMBL49373 0.81 FGFR1 (1.00) FGFR1SLC22A6CYP3A4ADCY5ENPP1
SCHEMBL8717563 0.80 FGFR1 (0.84) FGFR1SLC22A6CYP3A4ADCY5ENPP1
Adefovir SCHEMBL28511793 0.80 FGFR1 (0.97) FGFR1SLC22A6CYP3A4ADCY5ENPP1
Adefovir SCHEMBL3643715 0.80 FGFR1 (0.97) FGFR1SLC22A6CYP3A4ADCY5ENPP1
Adefovir SCHEMBL28765885 0.80 FGFR1 (0.97) FGFR1SLC22A6CYP3A4ADCY5ENPP1
Adefovir SCHEMBL3639260 0.80 FGFR1 (0.97) FGFR1SLC22A6CYP3A4ADCY5ENPP1
Adefovir SCHEMBL439995 0.80 FGFR1 (0.97) FGFR1SLC22A6CYP3A4ADCY5ENPP1
Adefovir SCHEMBL29115272 0.80 FGFR1 (0.97) FGFR1SLC22A6CYP3A4ADCY5ENPP1

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
WO-1999045016-A9 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS METABASIS THERAPEUTICS INC (US) 2000-03-02 WO disclosed