SCHEMBL8407355

SCHEMBL8407355

NCCCOP(O)(=S)OCCN

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 1/20 0.36
ITPR3 Q14573 1/20 0.36
ITPR1 Q14643 1/20 0.36
LPAR3 Q9UBY5 4/20 0.35
LPAR2 Q9HBW0 3/20 0.35
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
NFKB1 P19838 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
GABBR2 O75899 1/20 0.30
CYP1A2 P05177 1/20 0.30
TSHR P16473 1/20 0.30
THPO P40225 1/20 0.30
GABBR1 Q9UBS5 1/20 0.30

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
Water SCHEMBL27942868 0.98 ITPR3 (0.35) ODC1ITPR3ITPR1LPAR3LPAR2
Dodecylamine SCHEMBL11084017 0.77 LPAR3 (0.57) LPAR3LPAR2TSHR
Dodecylamine SCHEMBL11065806 0.77 LPAR3 (0.62) LPAR3LPAR2TSHR
SCHEMBL28089409 0.76
SCHEMBL27618256 0.76 LPAR2 (0.33) ITPR3ITPR1LPAR3LPAR2
Water SCHEMBL28794135 0.74 LPAR2 (0.32) ITPR3ITPR1LPAR3LPAR2
SCHEMBL12819009 0.74 LPAR3 (0.44) LPAR3LPAR2LMNABLMTSHR
SCHEMBL3501699 0.74
SCHEMBL5585483 0.72
SCHEMBL6933398 0.71 LPAR3 (0.61) LPAR3LPAR2LMNABLMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100365001-C Synthesis method of 3-amino propylomine ethyl thio phosphoric acid INST OF RADIATION AND RADIOMED (CN) 2008-01-30 CN claimed
CN-1752092-A The synthetic method of 3-aminopropylaminoethylthiophosphoric INST OF RADIATION AND RADIOMED (CN) 2006-03-29 CN claimed
CN-119752394-A Aqueous polyurethane adhesive, preparation method and application thereof in lithium ion battery 万华化学集团电池科技有限公司 2025-04-04 CN disclosed
CN-102260288-B Synthesis method of 3-amino-propyl aminoethyl thiophosphate trihydrate CHENGDU DAYOUDE PHARMACEUTICAL CO LTD 2014-02-26 CN disclosed
CN-102260288-A Synthesis method of 3-amino-propyl aminoethyl thiophosphate trihydrate 2011-11-30 CN disclosed
CN-100365001-C Synthesis method of 3-amino propylomine ethyl thio phosphoric acid INST OF RADIATION AND RADIOMED (CN) 2008-01-30 CN disclosed
CN-100365001-C Synthesis method of 3-amino propylomine ethyl thio phosphoric acid INST OF RADIATION AND RADIOMED (CN) 2008-01-30 CN disclosed
CN-1752092-A The synthetic method of 3-aminopropylaminoethylthiophosphoric INST OF RADIATION AND RADIOMED (CN) 2006-03-29 CN disclosed
CN-1752001-A The preparation method of sodium thiophosphate INST OF RADIATION AND RADIOMED (CN) 2006-03-29 CN disclosed
US-5902610-A ADMINISTERING WITH OR WITHOUT CISPLATIN IN THE SAME FORMULATION, TO REDUCE TOXIC SIDE EFFECTS OF CISPLATIN IN CANCER THERAPY AND POTENTIATE ITS ANTITUMOR ACTIVITY BIONUMERIK PHARMACEUTICALS, INC. (US) 1999-05-11 US disclosed
US-5866617-A AQUEOUS SOLUTION FOR ADMINISTRATION TO PATIENTS ALSO RECEIVING CISPLATIN; REDUCED SIDE EFFECTS, INCREASED ANTITUMOR ACTIVITY BIONUMERIK PHARMACEUTICALS, INC. (US) 1999-02-02 US disclosed
US-5866615-A LYOPHILIZED FORMULATION WITH ANTICANCER AGENTS; REDUCED SIDE EFFECTS, INCREASED ACTIVITY BIONUMERIK PHARMACEUTICALS, INC. (US) 1999-02-02 US disclosed
US-5866169-A LYOPHILIZED FORMULATION WITH CISPLATIN; REDUCED SIDE EFFECTS, INCREASED ANTITUMOR ACTIVITY BIONUMERIK PHARMACEUTICALS, INC. (US) 1999-02-02 US disclosed
US-5789000-A Sterile aqueous parenteral formulations of cis-diammine dichloro platinum BIONUMERIK PHARMACEUTICALS, INC. (US) 1998-08-04 US disclosed