SCHEMBL18569320

SCHEMBL18569320

CCCCCN1C(=O)c2ccccc2C1c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
FFAR1 O14842 1/20 0.45
ALDH2 P05091 1/20 0.44
ALDH3A1 P30838 1/20 0.44
KDM4E B2RXH2 1/20 0.44
CNR2 P34972 3/20 0.43
CES1 P23141 2/20 0.43
CDC25A P30304 1/20 0.43
CNR1 P21554 1/20 0.43

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
SCHEMBL18568866 0.90 GAA (0.68) GAAL3MBTL1MEN1KMT2AALDH1A1
Ubisindine SCHEMBL191543 0.81 TSHR (0.62) GAAL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL8273732 0.80 ALDH1A1 (0.50) GAAL3MBTL1ALDH1A1HPGDFFAR1
SCHEMBL18569319 0.80 GAA (0.44) GAAL3MBTL1ALDH1A1HPGDFFAR1
SCHEMBL27091877 0.79 CNR2 (0.49) GAAMEN1KMT2AALDH1A1ALDH2
SCHEMBL19976649 0.79 L3MBTL1 (0.57) GAAL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL8273178 0.79 GAA (0.55) GAAL3MBTL1ALDH1A1FFAR1KDM4E
SCHEMBL22781472 0.79 GAA (0.55) GAAL3MBTL1ALDH1A1HPGDFFAR1
SCHEMBL17366180 0.79 GAA (0.55) GAAL3MBTL1ALDH1A1HPGDFFAR1
SCHEMBL9893329 0.78 TOP1 (0.52) GAAL3MBTL1ALDH1A1HPGDFFAR1

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-1786773-B1 ISOINDOLIN-1-ONE DERIVATIVES CANCER RES TECH LTD (GB) 2017-03-01 EP disclosed