SCHEMBL7843702

SCHEMBL7843702

CN(C)c1ccc(C(=O)Nc2ccc(NC(=S)NCCc3ccc(F)cc3)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.69
ALDH1A1 P00352 4/20 0.69
RAB9A P51151 3/20 0.69
NPC1 O15118 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
KMT2A Q03164 7/20 0.63
MEN1 O00255 5/20 0.63
POLB P06746 1/20 0.63
HTT P42858 2/20 0.59
GAA P10253 2/20 0.59
LMNA P02545 2/20 0.58
ALOX12 P18054 1/20 0.58
TP53 P04637 1/20 0.56
MAPK1 P28482 1/20 0.56
NAMPT P43490 1/20 0.53
CNR1 P21554 1/20 0.52
MCHR1 Q99705 1/20 0.51
PLA2G1B P04054 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51
HDAC1 Q13547 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
SCHEMBL7782533 0.91 MAPT (0.79) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7785670 0.91 MAPT (0.79) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7567762 0.86 MAPT (0.72) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7569043 0.85 MAPT (0.81) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7782979 0.85 MAPT (0.70) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7843705 0.85 MEN1 (0.53) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7598228 0.84 MAPT (0.73) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7784395 0.84 MAPT (0.69) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7574135 0.83 MAPT (0.67) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7596301 0.83 RAB9A (0.57) MAPTALDH1A1RAB9ANPC1SMN1; SMN2

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-1140913-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 EP disclosed
EP-1137645-A2 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP 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-2000034260-A2 ALPHA-METHYLBENZYL-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A PHENYLENEDIAMINE GROUP 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
WO-2000034268-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed