SCHEMBL9756854

SCHEMBL9756854

Cc1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1S(=O)(=O)c1ccc(Br)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.47
LMNA P02545 5/20 0.47
NPSR1 Q6W5P4 2/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
POLB P06746 2/20 0.46
MAPT P10636 2/20 0.46
SFRP1 Q8N474 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GAA P10253 2/20 0.43
HPGD P15428 1/20 0.43
PKM P14618 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CA2 P00918 1/20 0.41
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PLCG1 P19174 1/20 0.39

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
SCHEMBL4616375 0.88 LMNA (0.45) ALDH1A1LMNANPSR1TSHRHTT
SCHEMBL4616505 0.88 CA2 (0.50) ALDH1A1LMNANPSR1TSHRHTT
SCHEMBL23105038 0.84 KMT2A (0.48) ALDH1A1LMNANPSR1MAPTPKM
SCHEMBL11599302 0.83 ALDH1A1 (0.66) ALDH1A1LMNANPSR1TSHRHTT
SCHEMBL8978705 0.81 HSD11B1 (0.47) ALDH1A1LMNANPSR1TSHRHTT
SCHEMBL10783820 0.79 MAPT (0.50) ALDH1A1LMNANPSR1HTTSMN1; SMN2
SCHEMBL8529690 0.78 POLB (0.53) ALDH1A1SMN1; SMN2POLBMAPTL3MBTL1
SCHEMBL8064328 0.78 POLB (0.53) ALDH1A1SMN1; SMN2POLBMAPTL3MBTL1
SCHEMBL2122562 0.77 CA2 (0.62) ALDH1A1LMNATSHRHTTMAPT
SCHEMBL250285 0.77 CA2 (0.62) ALDH1A1LMNATSHRHTTMAPT

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