Allylamine

Allylamine

SCHEMBL9751261

C=CCN.CCCS(=O)(=O)O

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
SLC6A6 P31641 1/20 0.44
CYP2C19 P33261 1/20 0.44
BLM P54132 1/20 0.44
ALDH1A1 P00352 1/20 0.41
APP P05067 1/20 0.41
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
EPHX2 P34913 1/20 0.32
TSHR P16473 1/20 0.31

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
SCHEMBL28481099 0.88 LMNA (0.43) LMNASLC6A6CYP2C19BLMALDH1A1
SCHEMBL28301829 0.86 LMNA (0.36) LMNASLC6A6CYP2C19BLMALDH1A1
Allylamine SCHEMBL2525605 0.85 ALDH1A1 (0.50) LMNASLC6A6CYP2C19BLMALDH1A1
Propene SCHEMBL28059885 0.83 LMNA (0.38) LMNASLC6A6CYP2C19BLMALDH1A1
Ethylamine SCHEMBL27427305 0.83 LMNA (0.55) LMNASLC6A6CYP2C19BLMAPP
Propene SCHEMBL28087209 0.81 LMNA (0.36) LMNASLC6A6CYP2C19BLMALDH1A1
Ethylenediamine SCHEMBL11516782 0.80 LMNA (0.60) LMNASLC6A6CYP2C19BLMAPP
Propylamine SCHEMBL9156759 0.80 LMNA (0.60) LMNASLC6A6CYP2C19BLMAPP
Acrylamide SCHEMBL35701 0.80 TSHR (0.48) LMNASLC6A6CYP2C19BLMALDH1A1
Methylamine SCHEMBL28108487 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114478960-B Plugging material and preparation method and application thereof 中国石油化工股份有限公司 2023-10-10 CN claimed
CN-114479783-B Composite plugging material and preparation method and application thereof 中国石油化工股份有限公司 2023-07-28 CN claimed
EP-0396739-A4 HYPOCHLORITE COMPOSITIONS CONTAINING THIOSULFATE AND USE THEREOF 1991-04-24 EP disclosed
EP-0396739-A1 HYPOCHLORITE COMPOSITIONS CONTAINING THIOSULFATE AND USE THEREOF BRANDEIS UNIVERSITY (US) 1990-11-14 EP disclosed
WO-1990005529-A1 HYPOCHLORITE COMPOSITIONS CONTAINING THIOSULFATE AND USE THEREOF BRANDEIS UNIVERSITY (US) 1990-05-31 WO disclosed
US-4908215-A Hypochlorite, alkali or alkaline earth metal thiosulfate; for disinfecting, bleaching, cleansing BRANDEIS UNIVERSITY (US) 1990-03-13 US disclosed