SCHEMBL3408166

SCHEMBL3408166

CCN(CC)C(=S)SCC#N

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.58
PHGDH O43175 3/20 0.58
ALDH1A1 P00352 8/20 0.50
LMNA P02545 4/20 0.50
HPGD P15428 4/20 0.50
ALDH2 P05091 3/20 0.50
EHMT2 Q96KQ7 3/20 0.50
EHMT1 Q9H9B1 3/20 0.50
HTT P42858 3/20 0.50
PKM P14618 3/20 0.50
CYP3A4 P08684 2/20 0.50
ABCB11 O95342 2/20 0.50
GSDMD P57764 2/20 0.50
PLIN1 O60240 1/20 0.50
GMNN O75496 1/20 0.50
TRPA1 O75762 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HTR1A P08908 1/20 0.50

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
SCHEMBL28037285 0.79 PHGDH (0.54) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL21578160 0.78 MGLL (0.58) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL1618721 0.77
SCHEMBL13296406 0.77 MGLL (0.56) MGLLPHGDHALDH1A1LMNAHPGD
Water SCHEMBL27534296 0.75 MGLL (0.65) MGLLPHGDHALDH1A1LMNAHPGD
Ammonia Solution, Strong SCHEMBL27703486 0.75 MGLL (0.65) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL9405282 0.74 MGLL (1.00) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL21221395 0.74 MGLL (0.71) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL27347285 0.74 MGLL (0.71) MGLLPHGDHALDH1A1LMNAHPGD
SCHEMBL5972447 0.74 MGLL (0.71) MGLLPHGDHALDH1A1LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11575156-B2 Diselenoester electrolyte additives for fast charging lithium ion batteries StoreDot Ltd. (IL) 2023-02-07 US disclosed
US-11205796-B2 Electrolyte additives in lithium-ion batteries StoreDot Ltd. (IL) 2021-12-21 US disclosed
US-20210242497-A1 DISELENOESTER ELECTROLYTE ADDITIVES FOR FAST CHARGING LITHIUM ION BATTERIES StoreDot Ltd. (IL) 2021-08-05 US disclosed
US-20210242500-A1 ELECTROLYTES FOR FAST CHARGING LITHIUM ION BATTERIES HAVING FOUR-CARBON CHAIN ESTERS AS LINEAR COMPONENTS StoreDot Ltd. (IL) 2021-08-05 US disclosed
US-20210234197-A1 ELECTROLYTE ADDITIVES FOR FAST CHARGING LITHIUM ION BATTERIES StoreDot Ltd. (IL) 2021-07-29 US disclosed
US-20190356013-A1 ELECTROLYTE ADDITIVES IN LITHIUM-ION BATTERIES StoreDot Ltd. (IL) 2019-11-21 US disclosed
US-20190198912-A1 ELECTROLYTE ADDITIVES IN LITHIUM-ION BATTERIES StoreDot Ltd. (IL) 2019-06-27 US disclosed
US-8445610-B2 Controlled radical polymerization processes CARNEGIE MELLON UNIVERSITY (US) 2013-05-21 US disclosed
US-8445610-B2 Controlled radical polymerization processes CARNEGIE MELLON UNIVERSITY (US) 2013-05-21 US disclosed
US-20110046324-A1 IMPROVED CONTROLLED RADICAL POLYMERIZATION PROCESSES MATYJASZEWSKI KRZYSZTOF 2011-02-24 US disclosed
US-20110046324-A1 IMPROVED CONTROLLED RADICAL POLYMERIZATION PROCESSES MATYJASZEWSKI KRZYSZTOF 2011-02-24 US disclosed
EP-2257573-A1 IMPROVED CONTROLLED RADICAL POLYMERIZATION PROCESSES Carnegie Mellon University (US) 2010-12-08 EP disclosed
WO-2009111725-A1 IMPROVED CONTROLLED RADICAL POLYMERIZATION PROCESSES CARNEGIE MELLON UNIVERSITY (US) 2009-09-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110046324-A1 IMPROVED CONTROLLED RADICAL POLYMERIZATION PROCESSES TRRAP, ATR, ATRIP MGLL 3212/4885PHGDH 4427/4885ALDH1A1 1632/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.