SCHEMBL7784385

SCHEMBL7784385

CO/N=C(\C)c1ccc(C(F)(F)F)c(F)c1.CO/N=C(\C)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPFFR2 Q9Y5X5 2/20 0.45
KIF11 P52732 2/20 0.42
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 2/20 0.38
GAA P10253 2/20 0.37
KCNQ3 O43525 1/20 0.37
KCNQ2 O43526 1/20 0.37
KCNE1 P15382 1/20 0.37
KCNQ1 P51787 1/20 0.37
RAB9A P51151 1/20 0.36
ATM Q13315 1/20 0.35
SLC6A4 P31645 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL6816717 0.90 KIF11 (0.49) NPFFR2KIF11MEN1KMT2ASMN1; SMN2
SCHEMBL6816713 0.90 KIF11 (0.49) NPFFR2KIF11MEN1KMT2ASMN1; SMN2
SCHEMBL7868613 0.90 NPFFR2 (0.38) NPFFR2KIF11MEN1KMT2ASMN1; SMN2
SCHEMBL7784388 0.86 NPFFR2 (0.37) NPFFR2KIF11MEN1KMT2APOLB
SCHEMBL6816462 0.83 NPFFR2 (0.62) NPFFR2GAARAB9AMAPT
SCHEMBL6816458 0.83 NPFFR2 (0.62) NPFFR2GAARAB9AMAPT
SCHEMBL6811427 0.83 NPFFR2 (0.56) NPFFR2MEN1KMT2ASMN1; SMN2GAA
SCHEMBL6811431 0.83 NPFFR2 (0.56) NPFFR2MEN1KMT2ASMN1; SMN2GAA
SCHEMBL6811369 0.81 SLC6A4 (0.45) NPFFR2MEN1KMT2ASMN1; SMN2POLB
SCHEMBL6811367 0.81 SLC6A4 (0.45) NPFFR2MEN1KMT2ASMN1; SMN2POLB

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-1137632-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
EP-1137633-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING 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-2000034237-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed