SCHEMBL10974937

SCHEMBL10974937

CCCCC(N)C(=O)On1cnc2c(Cl)ncnc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.40
FDPS P14324 1/20 0.39
FGFR1 P11362 6/20 0.38
FGFR4 P22455 6/20 0.38
HDAC6 Q9UBN7 1/20 0.35
ADA P00813 4/20 0.35
PDE2A O00408 3/20 0.35
CYP3A4 P08684 2/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
ALOX15 P16050 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL28077123 0.76 NNMT (0.45) ADAPDE2ACYP3A4PDE4APDE4B
SCHEMBL22458325 0.75 FGFR1 (0.45) P2RX7FDPSFGFR1FGFR4HDAC6
SCHEMBL9663409 0.73 MARS1 (0.58) ALDH1A1ADORA2A
SCHEMBL1577868 0.71 ADORA2A (0.46) CYP3A4ALDH1A1ADORA2A
SCHEMBL2365052 0.71 ASAH1 (0.44) FGFR1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL6897158 0.70 ALDH1A1 (0.34) ALDH1A1ADORA2A
SCHEMBL8849512 0.69 FGFR1 (0.41) P2RX7FDPSFGFR1FGFR4HDAC6
SCHEMBL30254206 0.68 P2RX7 (0.53) P2RX7FDPSFGFR1FGFR4HDAC6
SCHEMBL7271295 0.68 FDPS (0.49) P2RX7FDPSFGFR1FGFR4HDAC6
SCHEMBL29782820 0.68 ADA (0.43) FDPSFGFR1FGFR4ADAPDE2A

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-0073143-B1 NOVEL COMPLEX AMIDO AND IMIDO DERIVATIVES OF CARBOXYALKYL PEPTIDES AND THIOETHERS AND ETHERS OF PEPTIDES Ryan, James Walter (US) 1985-11-21 EP disclosed