SCHEMBL6422599

SCHEMBL6422599

O=S(=O)(c1cc(Cl)ccc1Cl)C1CNCCO1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.54
PKM P14618 1/20 0.46
ALDH1A1 P00352 1/20 0.43
TSHR P16473 2/20 0.42
ALOX15 P16050 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ATM Q13315 1/20 0.42
KMT2A Q03164 1/20 0.39
SLC6A2 P23975 6/20 0.39
SLC6A4 P31645 6/20 0.39
SGK1 O00141 1/20 0.39
ACHE P22303 1/20 0.38
SLC6A3 Q01959 2/20 0.38
CNR1 P21554 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL10781545 0.80 MAPT (0.44)
SCHEMBL29266390 0.78 LMNA (0.39) SGK1SLC6A3
SCHEMBL29266368 0.75 SSTR4 (0.38) SGK1SLC6A3
SCHEMBL6745832 0.74 CTSB (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL5175530 0.71 CTSB (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL27370620 0.71 CTSB (0.41) PKMSLC6A2SLC6A4SLC6A3
SCHEMBL6749403 0.71 GAA (0.41) SLC6A2SLC6A4SLC6A3
SCHEMBL28283507 0.70 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL6422590 0.70 SLC6A2 (0.38) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL29060820 0.70 USP2 (1.00) USP2PKMALDH1A1TSHRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0489085-B1 RIGID-ROD POLYMERS MISSISSIPPI POLYMER TECHNOLOGI (US) 2005-12-07 EP disclosed
US-5659005-A Rigid-rod polymers MAXDEM INCORPORATED (US) 1997-08-19 US disclosed
US-5565543-A Rigid-rod polymers MAXDEM INCORPORATED (US) 1996-10-15 US disclosed
US-5227457-A Rigid-rod polymers MAXDEM INCORPORATED (US) 1993-07-13 US disclosed
EP-0489085-A4 RIGID-ROD POLYMERS MAXDEM INC (US) 1992-08-05 EP disclosed
EP-0489085-A1 RIGID-ROD POLYMERS MAXDEM INCORPORATED (US) 1992-06-10 EP disclosed
WO-1991002764-A1 RIGID-ROD POLYMERS MAXDEM INCORPORATED (US) 1991-03-07 WO disclosed