SCHEMBL88218

SCHEMBL88218

Cn1c(N)c(N)c(=O)n(C)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.47
GLA P06280 1/20 0.47
KMT2A Q03164 3/20 0.46
POLB P06746 3/20 0.42
HTT P42858 2/20 0.42
MAPT P10636 3/20 0.38
HIF1A Q16665 2/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
PABPC1 P11940 1/20 0.37
LMNA P02545 2/20 0.37
ATAD2 Q6PL18 2/20 0.36
TSHR P16473 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ADORA2A P29274 2/20 0.35
PIK3CD O00329 1/20 0.35
ALPL P05186 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
TMIGD3 P0DMS9 1/20 0.35

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 SCHEMBL3902406 0.97 ALDH1A1 (0.46) ALDH1A1KDM4EGLAKMT2APOLB
Hydrochloric Acid SCHEMBL6316692 0.97 ALDH1A1 (0.46) ALDH1A1KDM4EGLAKMT2APOLB
Sulfurous Acid SCHEMBL5098561 0.89 ALDH1A1 (0.44) ALDH1A1KDM4EGLAKMT2APOLB
SCHEMBL15384321 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EGLAKMT2APOLB
SCHEMBL480553 0.77 ATAD2 (0.39) ALDH1A1KDM4EGLAKMT2APOLB
SCHEMBL3056710 0.77 ALDH1A1 (0.34) ALDH1A1KDM4EGLAKMT2APOLB
SCHEMBL9747188 0.75 CASP6 (0.59) ALDH1A1KDM4EKMT2APOLBMAPT
SCHEMBL28438188 0.75 ADORA2A (0.45) ALDH1A1KDM4EGLAPOLBHTT
SCHEMBL28429328 0.75 TSHR (0.46) ALDH1A1KDM4EGLAPOLBHTT
SCHEMBL7321782 0.73 ADORA2A (0.46) ALDH1A1POLBHTTMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115612699-B Copolymer membrane, and enzymatic self-assembly synthesis method and application thereof in gas-liquid interface 中国科学院天津工业生物技术研究所 2024-10-25 CN claimed
CN-117174999-A Polymer electrolyte, preparation method thereof and battery 浙江正泰电器股份有限公司 2023-12-05 CN claimed
CN-115612403-B Self-assembled strong-adhesion copolymer film, coating method and application 中国科学院天津工业生物技术研究所 2023-12-01 CN claimed
CN-114560983-B Flame-retardant self-repairing type water-based polyurethane composite finishing agent and preparation method and application thereof 陕西科技大学 2023-07-04 CN claimed
CN-111072574-B 5, 6-diamino-1, 3-dialkyl substituted uracil and its preparation method 广东工业大学 2023-03-14 CN claimed
WO-2023284777-A1 COPOLYMER FILM, ENZYME CATALYSIS SELF-ASSEMBLY SYNTHESIS METHOD THEREFOR, AND APPLICATION THEREOF 中国科学院天津工业生物技术研究所 2023-01-19 WO claimed
CN-115612403-A Self-assembly strong-adhesion copolymer film, film coating method and application 中国科学院天津工业生物技术研究所 2023-01-17 CN claimed
CN-115612114-A Copolymer membrane and enzymatic self-assembly synthesis method and application thereof 中国科学院天津工业生物技术研究所 2023-01-17 CN claimed
CN-114560983-A Flame-retardant self-repairing waterborne polyurethane composite coating agent and preparation method and application thereof 陕西科技大学 2022-05-31 CN claimed
CN-112209930-A Istradefylline derivative and preparation method and application thereof 山东新华制药股份有限公司 2021-01-12 CN claimed
WO-2003006579-A1 PROCESS FOR REDUCING COKE AGGLOMERATION IN COKING PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2003-01-23 WO claimed
EP-0845438-B1 Oxygen scavenger and boiler water treatment chemical KURITA WATER IND LTD (JP) 2001-09-19 EP claimed
EP-0743574-B1 Migration imaging members XEROX CORP (US) 2000-12-27 EP claimed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 EP claimed
EP-0673783-B1 Recording sheets containing purine, pyrimidine, benzimidazole, imidazolidine, urazole, pyrazole, triazole, benzotriazole, tetrazole, and pyrazine compounds XEROX CORP (US) 2000-07-05 EP claimed
EP-0845438-A1 Oxygen scavenger and boiler water treatment chemical KURITA WATER INDUSTRIES LTD. (JP) 1998-06-03 EP claimed
US-5659348-A APPLYING TO A SUBSTRATE XEROX CORPORATION (US) 1997-08-19 US claimed
US-5510484-A Process for preparing 1,3-dimethy-4,5-diaminouracil BOEHRINGER INGELHEIM KG (DE) 1996-04-23 US claimed
EP-0673783-A2 Recording sheets containing purine, pyrimidine, benzimidazole, imidazolidine, urazole, pyrazole, triazole, benzotriazole, tetrazole, and pyrazine compounds XEROX CORPORATION (US) 1995-09-27 EP claimed
EP-0619310-A1 Improved process for the preparation of 1,3-dimethyl-4,5-diamino-uracil BOEHRINGER INGELHEIM KG (DE) 1994-10-12 EP claimed