SCHEMBL7784348

SCHEMBL7784348

O=C(Cc1ccccc1)Nc1ccc(NC(=S)NCCc2ccc(F)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.66
ALDH1A1 P00352 7/20 0.66
SMN1; SMN2 Q16637 4/20 0.66
RAB9A P51151 3/20 0.66
NPC1 O15118 2/20 0.66
LMNA P02545 5/20 0.64
ALOX12 P18054 1/20 0.64
MAOA P21397 2/20 0.63
MAOB P27338 2/20 0.63
GAA P10253 4/20 0.62
KMT2A Q03164 7/20 0.62
HTT P42858 3/20 0.62
MEN1 O00255 5/20 0.61
MAPK1 P28482 2/20 0.61
TP53 P04637 1/20 0.61
POLB P06746 2/20 0.60
LTA4H P09960 1/20 0.57
EPHX2 P34913 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57

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
SCHEMBL22289694 0.87 RAB9A (0.79) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL7782979 0.85 MAPT (0.70) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL7597335 0.85 MAPT (0.73) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL10977880 0.84 GAA (0.83) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL14612489 0.83 RAB9A (0.77) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL8803541 0.82 LTA4H (0.79) ALDH1A1SMN1; SMN2RAB9ANPC1GAA
SCHEMBL7566619 0.82 MAPT (0.81) MAPTALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL7784349 0.82 GAA (0.54) ALDH1A1SMN1; SMN2RAB9ANPC1GAA
SCHEMBL14096629 0.81 RAB9A (0.69) MAPTALDH1A1RAB9ALMNAALOX12
SCHEMBL10977876 0.81 GAA (0.83) ALDH1A1SMN1; SMN2RAB9ANPC1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1137633-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
EP-1137647-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034237-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed