SCHEMBL11610697

SCHEMBL11610697

Cc1cccc(-n2c(=O)n(SC(Cl)(Cl)Cl)n(SC(Cl)(Cl)Cl)c2=O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.44
MGLL Q99685 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
PAX8 Q06710 1/20 0.41
ALDH1A1 P00352 3/20 0.40
NOTUM Q6P988 1/20 0.40
APLNR P35414 1/20 0.39
RGS4 P49798 1/20 0.38
RGS8 P57771 1/20 0.38
ALOX5 P09917 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
CRHBP P24387 1/20 0.37
KMT2A Q03164 1/20 0.37
CRHR2 Q13324 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MAT2A P31153 1/20 0.37

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
SCHEMBL11607792 0.84 ALDH1A1 (0.54) MGLLRAB9AALDH1A1NOTUMALOX5
SCHEMBL11607976 0.80 GSK3B (0.48) ALDH1A1MEN1KMT2A
SCHEMBL16004434 0.79 HSP90AA1 (0.59) HSP90AA1MGLLL3MBTL1NPC1RAB9A
SCHEMBL11606006 0.74 TP53 (0.39) ALDH1A1NOTUMRGS4RGS8MAPT
SCHEMBL11607018 0.73 GSK3A (0.59) ALDH1A1
SCHEMBL11367922 0.72 ALDH1A1 (0.65) HSP90AA1MGLLL3MBTL1ALDH1A1NOTUM
SCHEMBL11606563 0.71 GSK3A (0.46) MGLLNPC1RAB9ANOTUMALOX5
SCHEMBL11609052 0.71 NPC1 (0.34) NPC1RAB9AALDH1A1
SCHEMBL17931794 0.70 CYP1A2 (0.57) HSP90AA1MGLLALDH1A1NOTUMMAPT
SCHEMBL11606034 0.70 GSK3A (0.50) MGLLL3MBTL1NPC1RAB9APAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4087534-A N-haloalkylmio urazole pesticides OVADIA DAVID 1978-05-02 US disclosed