SCHEMBL27656249

SCHEMBL27656249

O=C(O)c1nnc2cccc(F)c2c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALB P02768 1/20 0.44
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
DYRK1A Q13627 2/20 0.36
PARP1 P09874 2/20 0.36
KDM4E B2RXH2 3/20 0.35
ASPH Q12797 1/20 0.35
KDM8 Q8N371 1/20 0.35
TTR P02766 1/20 0.35
MGAM O43451 1/20 0.35
AMY1A P0DUB6 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
RARG P13631 1/20 0.34
RORC P51449 1/20 0.34
ERN1 O75460 2/20 0.33

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
SCHEMBL10861357 0.78 GABRA1 (0.44) ALDH1A1MAPTSMN1; SMN2KDM4EMEN1
SCHEMBL1123893 0.75 ALB (0.46) ALBALDH1A1MAPTSMN1; SMN2DYRK1A
SCHEMBL31371878 0.72 LCK (0.51) ALDH1A1MAPTSMN1; SMN2DYRK1AKDM4E
SCHEMBL7706331 0.72 LCK (0.51) ALDH1A1MAPTSMN1; SMN2DYRK1AKDM4E
SCHEMBL8645930 0.71 ALDH1A1 (0.50) ALBALDH1A1MAPTSMN1; SMN2DYRK1A
SCHEMBL27260256 0.70 ALB (0.41) ALBPARP1CES2CES1MEN1
SCHEMBL27032773 0.66 PARP1 (0.41) ALBALDH1A1PARP1TTRMGAM
SCHEMBL3328166 0.66 MGAM (0.42) ALBALDH1A1PARP1KDM4EMGAM
SCHEMBL20839321 0.65 TTR (0.34) KDM4ETTRAKR1C2AKR1C1
SCHEMBL2437553 0.64 KDM4E (0.42) ALBALDH1A1MAPTSMN1; SMN2DYRK1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100471842-C Carbostyril derivative or salt thereof ASTELLAS PHARMA INC (JP) 2009-03-25 CN disclosed
CN-1826321-A Quinolone derivative or its salt YAMANOUCHI PHARMA CO LTD (JP) 2006-08-30 CN disclosed