SCHEMBL9756893

SCHEMBL9756893

O=S(=O)(c1cccc(I)c1)c1ccc2cc(S(=O)(=O)c3cccc(I)c3)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.48
HTR2C P28335 1/20 0.48
LMNA P02545 4/20 0.45
KMT2A Q03164 3/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
LOX P28300 2/20 0.41
LOXL2 Q9Y4K0 2/20 0.41
MAOA P21397 1/20 0.41
ANXA2 P07355 1/20 0.40
S100A10 P60903 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
AKR1B1 P15121 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 2/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL30084552 0.89 LMNA (0.54) HTR6LMNAKMT2AGAAHTT
SCHEMBL3677379 0.89 LMNA (0.54) HTR6LMNAKMT2AGAAHTT
SCHEMBL3839132 0.83 HTR6 (0.61) HTR6HTR2CLMNAKMT2AGAA
SCHEMBL3673494 0.83 HTT (0.53) HTR6LMNAKMT2AGAAHTT
SCHEMBL20389273 0.81 HTR6 (0.59) HTR6LMNAKMT2AGAAHTT
SCHEMBL6058986 0.79 HTT (0.56) LMNAKMT2AGAAHTTL3MBTL1
SCHEMBL30468598 0.77 KMT2A (0.64) LMNAKMT2AGAAHTTSMN1; SMN2
SCHEMBL20379464 0.77 KMT2A (0.64) LMNAKMT2AGAAHTTSMN1; SMN2
SCHEMBL1952494 0.76 LMNA (0.68) LMNAHTTLOXLOXL2MAOA
Zinc Ion SCHEMBL6916857 0.75 LMNA (0.42) HTR6HTR2CLMNAKMT2AGAA

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
US-5045629-A Contacting with steam PHILLIPS PETROLEUM COMPANY (US) 1991-09-03 US disclosed
US-5037954-A Method to recover liquified poly(arylene sulfide) with separation agent PHILLIPS PETROLEUM COMPANY (US) 1991-08-06 US disclosed
EP-0436120-A2 Method to recover poly(arylene sulfide)s PHILLIPS PETROLEUM COMPANY (US) 1991-07-10 EP disclosed
US-4963651-A VAPOR PHASE SEPARATION; COOLING, SOLIDIFYING, SLURRYING PHILLIPS PETROLEUM COMPANY (US) 1990-10-16 US disclosed