SCHEMBL7861397

SCHEMBL7861397

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

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.40
NPC1 O15118 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
KMT2A Q03164 4/20 0.39
GAA P10253 2/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
BRPF1 P55201 1/20 0.37
PKM P14618 1/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
ULK1 O75385 1/20 0.35
MEN1 O00255 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL7785913 0.94 RAB9A (0.39) RAB9ANPC1L3MBTL1TDP1KMT2A
SCHEMBL7785682 0.89 L3MBTL1 (0.51) RAB9ANPC1L3MBTL1TDP1KMT2A
SCHEMBL7594340 0.88 NPC1 (0.48) RAB9ANPC1L3MBTL1TDP1KMT2A
SCHEMBL7599793 0.87 KMT2A (0.48) RAB9ANPC1L3MBTL1TDP1KMT2A
SCHEMBL7593301 0.87 PTPN1 (0.47) RAB9ANPC1L3MBTL1TDP1KMT2A
SCHEMBL7782996 0.85 RAB9A (0.43) RAB9ANPC1L3MBTL1TDP1KMT2A
SCHEMBL7782955 0.85 L3MBTL1 (0.47) RAB9ANPC1L3MBTL1KMT2AGAA
SCHEMBL7782562 0.85 L3MBTL1 (0.41) RAB9ANPC1L3MBTL1TDP1KMT2A
SCHEMBL7600058 0.85 NPC1 (0.42) RAB9ANPC1L3MBTL1TDP1KMT2A
SCHEMBL7600182 0.83 PTPN1 (0.42) RAB9ANPC1L3MBTL1TDP1KMT2A

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