SCHEMBL7861394

SCHEMBL7861394

N#CCOc1cc(NC(=S)NCCc2ccc(F)cc2)ccc1NC(=O)c1ccccc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.48
PKM P14618 1/20 0.48
MAPT P10636 8/20 0.47
MEN1 O00255 4/20 0.47
GAA P10253 3/20 0.47
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
RAB9A P51151 3/20 0.46
ALDH1A1 P00352 8/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.45
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 3/20 0.43
ALOX12 P18054 1/20 0.43
HDAC1 Q13547 1/20 0.42
HTT P42858 3/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
CACNA1B Q00975 1/20 0.42

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
SCHEMBL7785911 0.93 RAB9A (0.45) KMT2APKMMAPTMEN1GAA
SCHEMBL7785679 0.89 KMT2A (0.63) KMT2APKMMAPTMEN1GAA
SCHEMBL7594338 0.88 RAB9A (0.53) KMT2APKMMAPTMEN1GAA
SCHEMBL7599785 0.87 GAA (0.61) KMT2APKMMAPTMEN1GAA
SCHEMBL7593296 0.86 KMT2A (0.53) KMT2APKMMAPTMEN1GAA
SCHEMBL7782994 0.85 MAPT (0.51) KMT2AMAPTMEN1GAAPLA2G1B
SCHEMBL7782953 0.85 KMT2A (0.51) KMT2APKMMAPTMEN1GAA
SCHEMBL7600052 0.84 RAB9A (0.48) KMT2AMAPTMEN1RAB9AALDH1A1
SCHEMBL7782560 0.84 KMT2A (0.49) KMT2APKMMAPTMEN1GAA
SCHEMBL7784442 0.83 GAA (0.64) KMT2APKMMAPTMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1137632-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP claimed
WO-2000034238-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO claimed
EP-1140913-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 EP disclosed
EP-1137632-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034238-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034269-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed