SCHEMBL14880255

SCHEMBL14880255

Cc1cccc(C(=O)n2nnc3ccccc32)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGAM O43451 11/20 1.00
AMY1A P0DUB6 11/20 1.00
GAA P10253 11/20 1.00
SI P14410 11/20 1.00
MGAM2 Q2M2H8 11/20 1.00
KMT2A Q03164 5/20 0.71
HPGD P15428 2/20 0.70
F2 P00734 1/20 0.70
SLC9A1 P19634 1/20 0.70
F12 P00748 5/20 0.62
ELANE P08246 2/20 0.60
ALDH1A1 P00352 2/20 0.60
KDM4E B2RXH2 1/20 0.60
MAPT P10636 1/20 0.60
HTT P42858 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
MEN1 O00255 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58

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
SCHEMBL29433519 1.00 MGAM (1.00) MGAMAMY1AGAASIMGAM2
SCHEMBL16706437 0.84 MGAM (0.77) MGAMAMY1AGAASIMGAM2
SCHEMBL29433322 0.83 MGAM (1.00) MGAMAMY1AGAASIMGAM2
SCHEMBL2493561 0.83 MGAM (1.00) MGAMAMY1AGAASIMGAM2
SCHEMBL29728230 0.83 MGAM (0.71) MGAMAMY1AGAASIMGAM2
SCHEMBL28836634 0.83 MGAM (0.71) MGAMAMY1AGAASIMGAM2
SCHEMBL27397036 0.77 F12 (1.00) MGAMAMY1AGAASIMGAM2
SCHEMBL29996413 0.76 MGAM (0.61) MGAMAMY1AGAASIMGAM2
SCHEMBL2491371 0.76 MGAM (0.79) MGAMAMY1AGAASIMGAM2
SCHEMBL3900498 0.75 KCNMA1 (0.81) MGAMAMY1AGAASIMGAM2

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
WO-2020230136-A1 ACSS2 INHIBITORS AND METHODS OF USE THEREOF METABOMED LTD (IL) 2020-11-19 WO disclosed
WO-2013059582-A2 SMALL MOLECULE INHIBITORS OF HISTONE DEACTEYLASES NUPOTENTIAL, INC. (US) 2013-04-25 WO disclosed