SCHEMBL9735487

SCHEMBL9735487

CCC(OCc1ccccc1F)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
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
PKM P14618 2/20 0.34
SLC6A4 P31645 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 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

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
SCHEMBL9735483 0.79 NPC1 (0.37) NPC1MAPTRAB9ASMN1; SMN2IDO1
SCHEMBL30902518 0.67 NPC1 (0.53) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL6721585 0.67 IDO1 (0.38) NPC1MAPTRAB9ASMN1; SMN2IDO1
SCHEMBL20729407 0.65 IDO1 (0.50) NPC1MAPTRAB9AIDO1ALDH1A1
SCHEMBL3319862 0.65 MAPT (0.60) NPC1MAPTRAB9ASMN1; SMN2IDO1
SCHEMBL13577125 0.65 MAOB (0.55) NPC1MAPTRAB9ASMN1; SMN2IDO1
SCHEMBL6717128 0.64 SLC6A4 (0.42) IDO1ALDH1A1KMT2AMEN1SLC6A4
SCHEMBL8599131 0.64 SLC2A1 (0.39) NPC1GAA
SCHEMBL9769709 0.64 RORC (0.48) SLC6A4SLC6A2METSCN1ASCN5A
SCHEMBL10314840 0.63 IDO1 (0.55) NPC1MAPTRAB9AIDO1ALDH1A1

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