SCHEMBL20113643

SCHEMBL20113643

CCCc1cnc(C=O)c(CO)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
MEN1 O00255 2/20 0.37
LMNA P02545 2/20 0.37
KMT2A Q03164 2/20 0.37
AOX1 Q06278 1/20 0.37
TRIM24 O15164 1/20 0.36
TRIM33 Q9UPN9 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.33
PDXK O00764 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TP53 P04637 1/20 0.33
DHFR P00374 2/20 0.33
MITF O75030 1/20 0.33
KLF5 Q13887 1/20 0.33
FGFR4 P22455 1/20 0.31
MAPT P10636 2/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL20114328 0.83 SRC (0.38) KDM4EALDH1A1HPGDMEN1LMNA
SCHEMBL20113958 0.78 FFAR4 (0.33) KDM4EALDH1A1HPGDMEN1LMNA
SCHEMBL20113656 0.73 HTR2A (0.34) KDM4ESMN1; SMN2NPC1RAB9ATP53
SCHEMBL20113660 0.72 NPC1 (0.31) SMN1; SMN2NPC1RAB9ATP53PKM
SCHEMBL20113649 0.71 MEN1 (0.37) KDM4EALDH1A1HPGDMEN1LMNA
SCHEMBL22961170 0.68 NOS3 (0.37) KDM4EALDH1A1MEN1LMNAKMT2A
SCHEMBL20113872 0.68 NPC1 (0.31) NPC1RAB9A
SCHEMBL20113778 0.68 NR1I2 (0.32) FGFR4
SCHEMBL20113780 0.66 FGFR4 (0.32) FGFR4
SCHEMBL10299421 0.66 NFKB1 (0.38) KDM4EALDH1A1HPGDMEN1LMNA

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-3060563-B1 RING-FUSED BICYCLIC PYRIDYL DERIVATIVES AS FGFR4 INHIBITORS NOVARTIS AG (CH) 2018-05-02 EP disclosed