SCHEMBL8720523

SCHEMBL8720523

NC(=O)CNC(=S)Nc1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
POLB P06746 1/20 0.56
ALDH1A1 P00352 4/20 0.55
GAA P10253 3/20 0.52
LMNA P02545 3/20 0.52
ABAT P80404 1/20 0.51
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA4 P22748 1/20 0.51
CA9 Q16790 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
MAPK1 P28482 1/20 0.50
MAOB P27338 1/20 0.50
ALOX12 P18054 1/20 0.50

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
SCHEMBL4397986 0.83 ABAT (0.74) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL11634169 0.77 ALDH1A1 (0.66) IDO1MEN1KMT2APOLBALDH1A1
SCHEMBL5146332 0.77 ALDH1A1 (0.60) IDO1MEN1KMT2APOLBALDH1A1
SCHEMBL7657194 0.76 ALDH1A1 (0.66) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL8720521 0.76 ALDH1A1 (0.57) MEN1KMT2APOLBALDH1A1GAA
SCHEMBL7658700 0.76 ALDH1A1 (0.67) IDO1MEN1KMT2APOLBALDH1A1
SCHEMBL10099725 0.75 GAA (0.83) IDO1MEN1KMT2APOLBALDH1A1
SCHEMBL6096417 0.75 GAA (0.62) IDO1MEN1KMT2APOLBALDH1A1
SCHEMBL5518500 0.74 ALDH1A1 (0.55) MEN1KMT2AALDH1A1GAACA1
SCHEMBL6816535 0.74 MAPT (0.77) MEN1KMT2APOLBALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0876354-A1 2-(SUBSTITUTED SULFANYL)-3,5-DIHYDRO-IMIDAZOL-4-ONE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-11-11 EP disclosed
WO-1997019931-A1 2-(SUBSTITUTED SULFANYL)-3,5-DIHYDRO-IMIDAZOL-4-ONE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1997-06-05 WO disclosed
US-5599829-A FOR INCREASED HIGH DENSITY LIPOPROTEIN LEVELS IN BLOOD AMERICAN HOME PRODUCTS CORPORATION (US) 1997-02-04 US disclosed