SCHEMBL9735483

SCHEMBL9735483

CC(COCc1ccccc1F)Oc1cc(N)c(Cl)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
IDO1 P14902 2/20 0.37
SLC6A4 P31645 2/20 0.36
KDM4E B2RXH2 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
PKM P14618 1/20 0.34
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MCL1 Q07820 1/20 0.33
MPO P05164 1/20 0.32
PARP15 Q460N3 1/20 0.32
PARP10 Q53GL7 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL9735487 0.79 NPC1 (0.37) NPC1MAPTRAB9ASMN1; SMN2IDO1
SCHEMBL30902518 0.70 NPC1 (0.53) NPC1RAB9ASMN1; SMN2GAAMPO
SCHEMBL13676865 0.70 IDO1 (0.52) NPC1MAPTRAB9AIDO1SLC6A4
SCHEMBL9735484 0.69 NPC1 (0.52) NPC1SMN1; SMN2KDM4ETDP1GAA
SCHEMBL10853860 0.67 IDO1 (0.48) NPC1MAPTRAB9ASMN1; SMN2IDO1
SCHEMBL8599131 0.67 SLC2A1 (0.39) NPC1GAAMCHR1
SCHEMBL3277991 0.66 NPC1 (0.61) NPC1MAPTKDM4ETDP1KMT2A
SCHEMBL9734857 0.66 EGFR (0.36) NPC1KMT2AMEN1GAA
Toluene SCHEMBL28554507 0.66 NPC1 (0.47) NPC1MAPTKMT2AMEN1GAA
SCHEMBL9769674 0.65 MAOA (0.36) NPC1GAAMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5169428-A Tetrahydrophthalimide derivative and herbicide composition containing same TOSOH CORPORATION (JP) 1992-12-08 US disclosed
EP-0323271-A1 Tetrahydrophthalimide derivative and herbicide composition containing the same Tosoh Corporation (JP) 1989-07-05 EP disclosed