SCHEMBL9569691

SCHEMBL9569691

Nc1ccn(CCC(/C=C/P(=O)(O)O)CO)c(=O)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.49
SLC22A6 Q4U2R8 1/20 0.48
EP300 Q09472 7/20 0.33
PDE3A Q14432 2/20 0.32
PDE4D Q08499 1/20 0.32
SLC29A1 Q99808 1/20 0.32
LMNA P02545 2/20 0.32
THRB P10828 1/20 0.32
MTOR P42345 1/20 0.32
MDM2 Q00987 1/20 0.32
NCOA1 Q15788 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
MAPT P10636 2/20 0.32
CYP2D6 P10635 1/20 0.31
DNMT1 P26358 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
NT5E P21589 1/20 0.31
CACNA1F O60840 1/20 0.31
ALB P02768 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
SCHEMBL9569706 1.00 FGFR1 (0.49) FGFR1SLC22A6EP300PDE3APDE4D
SCHEMBL9569698 1.00 FGFR1 (0.49) FGFR1SLC22A6EP300PDE3APDE4D
SCHEMBL9569582 0.88 FGFR1 (0.57) FGFR1SLC22A6EP300PDE3APDE4D
SCHEMBL9569603 0.88 FGFR1 (0.57) FGFR1SLC22A6EP300PDE3APDE4D
SCHEMBL9569592 0.88 FGFR1 (0.57) FGFR1SLC22A6EP300PDE3APDE4D
SCHEMBL9569539 0.85 FGFR1 (0.46) FGFR1SLC22A6EP300MAPTCYP2D6
SCHEMBL9569548 0.85 FGFR1 (0.46) FGFR1SLC22A6EP300MAPTCYP2D6
SCHEMBL9569565 0.85 FGFR1 (0.46) FGFR1SLC22A6EP300MAPTCYP2D6
SCHEMBL9569440 0.85 FGFR1 (0.44) FGFR1SLC22A6EP300
SCHEMBL9569436 0.85 FGFR1 (0.44) FGFR1SLC22A6EP300

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-0532423-A1 Novel unsaturated acyclic phosphonate derivatives of purine and pyrimidine MERRELL DOW PHARMACEUTICALS INC. (US) 1993-03-17 EP claimed