SCHEMBL4368972

SCHEMBL4368972

S=[C]C(=S)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
MAPT P10636 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 2/20 0.41
HPGD P15428 2/20 0.41
KMT2A Q03164 2/20 0.41
HSP90AA1 P07900 1/20 0.41
GAA P10253 1/20 0.41
CES1 P23141 3/20 0.39
CES2 O00748 2/20 0.39
TSHR P16473 2/20 0.39
DAO P14920 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
POLB P06746 2/20 0.37
CYP3A4 P08684 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
F2 P00734 1/20 0.36
F10 P00742 1/20 0.36
F12 P00748 1/20 0.36
F7 P08709 1/20 0.36

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
SCHEMBL1219464 0.76 ALDH1A1 (0.42) ALDH1A1MAPTL3MBTL1MEN1HPGD
SCHEMBL302163 0.76 ALDH1A1 (0.43) ALDH1A1MAPTL3MBTL1MEN1HPGD
SCHEMBL10403407 0.70 CES1 (0.50) ALDH1A1MAPTL3MBTL1MEN1HPGD
Thiobenzoic Acid SCHEMBL37018 0.69
Thiobenzoic Acid SCHEMBL160729 0.69 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1MEN1HPGD
SCHEMBL329591 0.69 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1MEN1HPGD
Thiobenzoic Acid SCHEMBL28199536 0.69 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1MEN1HPGD
SCHEMBL10339337 0.69 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1MEN1HPGD
Thiobenzoic Acid SCHEMBL15282156 0.69 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1MEN1HPGD
SCHEMBL5683621 0.67 ALDH1A1 (0.48) ALDH1A1MAPTL3MBTL1MEN1HPGD

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3202803-B1 POLY(ETHYLENE GLYCOL)-B-POLY(HALOMETHYLSTYRENE) AND DERIVATIVES THEREOF, AND PRODUCTION PROCESS THEREFOR UNIV TSUKUBA (JP) 2019-09-18 EP claimed
US-10208152-B2 Poly(ethylene glycol)-b-poly(halomethylstyrene), derivative thereof, and method for producing same UNIVERSITY OF TSUKUBA (JP) 2019-02-19 US claimed
US-20170247491-A1 POLY(ETHYLENE GLYCOL)-B-POLY(HALOMETHYLSTYRENE), DERIVATIVE THEREOF, AND METHOD FOR PRODUCING SAME UNIVERSITY OF TSUKUBA (JP) 2017-08-31 US claimed
EP-3202803-A1 POLY(ETHYLENE GLYCOL)-B-POLY(HALOMETHYLSTYRENE) AND DERIVATIVES THEREOF, AND PRODUCTION PROCESS THEREFOR University of Tsukuba (JP) 2017-08-09 EP claimed
EP-3202803-B1 POLY(ETHYLENE GLYCOL)-B-POLY(HALOMETHYLSTYRENE) AND DERIVATIVES THEREOF, AND PRODUCTION PROCESS THEREFOR UNIV TSUKUBA (JP) 2019-09-18 EP disclosed
US-10208152-B2 Poly(ethylene glycol)-b-poly(halomethylstyrene), derivative thereof, and method for producing same UNIVERSITY OF TSUKUBA (JP) 2019-02-19 US disclosed
US-20170247491-A1 POLY(ETHYLENE GLYCOL)-B-POLY(HALOMETHYLSTYRENE), DERIVATIVE THEREOF, AND METHOD FOR PRODUCING SAME UNIVERSITY OF TSUKUBA (JP) 2017-08-31 US disclosed
EP-3202803-A1 POLY(ETHYLENE GLYCOL)-B-POLY(HALOMETHYLSTYRENE) AND DERIVATIVES THEREOF, AND PRODUCTION PROCESS THEREFOR University of Tsukuba (JP) 2017-08-09 EP disclosed
US-7476465-B2 High density; stability; n-heterocyclic polymer or oligomer NEC CORPORATION (JP) 2009-01-13 US disclosed
US-7312000-B2 Electrolytic solution for secondary battery and secondary battery containing the same NEC CORPORATION (JP) 2007-12-25 US disclosed
US-7018738-B2 Electrode and battery using same NEC CORPORATION (JP) 2006-03-28 US disclosed
US-20050100787-A1 High density; stability; n-heterocyclic polymer or oligomer NEC CORPORATION (JP) 2005-05-12 US disclosed
US-5457111-A Side effect reduction ABBOTT LABORATORIES (US) 1995-10-10 US disclosed
EP-0642516-A1 MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1995-03-15 EP disclosed
EP-0638082-A1 MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1995-02-15 EP disclosed
WO-1994021642-A1 MACROCYCLIC AMIDE AND UREA IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1994-09-29 WO disclosed
EP-0642516-A4 MACROCYCLIC IMMUNOMODULATORS. ABBOTT LAB (US) 1994-06-15 EP disclosed
EP-0638082-A4 MACROCYCLIC IMMUNOMODULATORS. ABBOTT LAB (US) 1994-06-09 EP disclosed
WO-1993004680-A1 MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1993-03-18 WO disclosed
WO-1993004679-A1 MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1993-03-18 WO disclosed