SCHEMBL2575802

SCHEMBL2575802

O=C(O)c1cncnc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.44
ERN1 O75460 1/20 0.38
KDM4E B2RXH2 7/20 0.36
NAPRT Q6XQN6 4/20 0.36
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4C Q9H3R0 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 1/20 0.36
KDM6B O15054 1/20 0.36
KDM4A O75164 1/20 0.36
THRB P10828 1/20 0.36
KDM4D Q6B0I6 1/20 0.36
ASPH Q12797 2/20 0.35
KDM8 Q8N371 1/20 0.35
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34

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
Ethane SCHEMBL27643616 0.96 HCAR2 (0.41) HCAR2ERN1KDM4ENAPRTALDH1A1
SCHEMBL626513 0.80 SIRT3 (0.42) KDM4EALDH1A1TDP1MAPTHPGD
SCHEMBL31132417 0.80 SIRT3 (0.42) KDM4EALDH1A1TDP1MAPTHPGD
SCHEMBL15023500 0.80 HCAR2 (0.43) HCAR2ERN1KDM4ENAPRTALDH1A1
SCHEMBL68960 0.77 KDM4E (0.47) HCAR2ERN1KDM4ENAPRTALDH1A1
SCHEMBL25171290 0.77 HCAR2 (0.40) HCAR2ERN1KDM4ENAPRTALDH1A1
SCHEMBL1667344 0.76 HPGD (0.47) HCAR2KDM4ENAPRTALDH1A1TDP1
SCHEMBL1344662 0.76 SMN1; SMN2 (0.48) HCAR2ERN1KDM4ENAPRTALDH1A1
SCHEMBL29364820 0.76 HPGD (0.47) HCAR2KDM4ENAPRTALDH1A1TDP1
SCHEMBL758324 0.76 NAPRT (0.48) HCAR2ERN1KDM4ENAPRTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119056253-A Chlorine-resistant high-flux nanofiltration membrane prepared based on grafting modification and preparation method thereof 浙江理工大学桐乡研究院有限公司 2024-12-03 CN claimed
EP-0015772-A1 N-(2-((acylaminoacylamino or aminoacylamino)phenyl)-4-hydroxy-5-pyrimidinylcarbonyl)cephalosporin compounds, processes for their production, and compositions containing the same WARNER-LAMBERT COMPANY (US) 1980-09-17 EP claimed
CN-119056253-A Chlorine-resistant high-flux nanofiltration membrane prepared based on grafting modification and preparation method thereof 浙江理工大学桐乡研究院有限公司 2024-12-03 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-104744446-B Heteroaryl compound and its application in drug 广东东阳光药业有限公司 2019-06-25 CN disclosed
EP-2758059-B1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME (US) 2018-10-24 EP disclosed
EP-2758058-B1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME (US) 2017-04-26 EP disclosed
EP-2560655-B1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME (US) 2016-08-24 EP disclosed
EP-1486489-B1 Fungicidal heterocyclic aromatic amides and their compositions, methods of use and preparation DOW AGROSCIENCES LLC (US) 2016-04-27 EP disclosed
EP-1516874-B1 Fungicidal heterocyclic aromatic amides and their compositions, methods of use and preparation DOW AGROSCIENCES LLC (US) 2015-08-19 EP disclosed
US-9096527-B2 TRPM8 antagonists and their use in treatments AMGEN INC. (US) 2015-08-04 US disclosed
EP-0711757-A1 3-(4-phenylpiperazin-1-yl)propyl-amino, thio and oxy -pyridine, pyrimidine and benzene derivatives as alpha1-adrenoceptor antagonists F. Hoffmann-La Roche AG (CH) 1996-05-15 EP disclosed
US-5089490-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-4758556-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-19 US disclosed
US-4399131-A Cephem derivatives HOECHST AG (DE) 1983-08-16 US disclosed
US-4315933-A PENICILLINS WARNER-LAMBERT COMPANY (US) 1982-02-16 US disclosed
US-4311699-A Aminoacid derivatives of cephalosporin compounds HASKELL THEODORE H 1982-01-19 US disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 US disclosed
US-4267180-A PENICILLINS AND DERIVATIVES WARNER-LAMBERT COMPANY (US) 1981-05-12 US disclosed
EP-0015772-A1 N-(2-((acylaminoacylamino or aminoacylamino)phenyl)-4-hydroxy-5-pyrimidinylcarbonyl)cephalosporin compounds, processes for their production, and compositions containing the same WARNER-LAMBERT COMPANY (US) 1980-09-17 EP disclosed