Bicarbonate

Bicarbonate

SCHEMBL9348277

O=C(O)O.O=C(O)O.OOCc1ccccc1.OOCc1ccccc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
KMT2A Q03164 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
MAPK1 P28482 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A3 Q01959 1/20 0.54
TSHR P16473 2/20 0.52
PARP10 Q53GL7 1/20 0.50
SRD5A2 P31213 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
NR4A1 P22736 1/20 0.48
NR4A2 P43354 1/20 0.48
NR4A3 Q92570 1/20 0.48
LMNA P02545 1/20 0.48
HCAR2 Q8TDS4 1/20 0.48
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
AKR1B1 P15121 1/20 0.48

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
SCHEMBL111650 0.92
SCHEMBL28253955 0.92 TSHR (0.60) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
SCHEMBL4363424 0.90 TSHR (0.57) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
Hydrochloric Acid SCHEMBL38661600 0.90 TSHR (0.57) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
Water SCHEMBL2348698 0.90 TSHR (0.57) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
Fluoride SCHEMBL27339282 0.90 TSHR (0.57) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
Ethaneperoxoic Acid SCHEMBL27833212 0.87 ALDH1A1 (0.64) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
Methylamine SCHEMBL28341679 0.85 IDO1 (0.54) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
Butane SCHEMBL5564092 0.83 TSHR (0.50) ALDH1A1KMT2ATDP1MAPK1L3MBTL1
Bicarbonate SCHEMBL9066694 0.82 ALDH1A1 (0.58) ALDH1A1KMT2ATDP1MAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5028720-A 6,7-nonsubstituted and 6,7-disubstituted-3,4-dihydroxy benzopyran-2H-one compounds having antiaggregatory properties and processes for their preparation OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1991-07-02 US claimed
EP-4482888-A1 POLYORGANOSILOXANE COPOLYMERS WITH ORGANIC POLYMERS Wacker Chemie AG (DE) 2025-01-01 EP disclosed
CN-119213071-A Impact modified polypropylene composition, articles and method of making the same 布拉斯科有限公司 2024-12-27 CN disclosed
EP-4384392-A1 METAL-PLATED LAMINATES CONTAINING POLYORGANOSILOXANES Wacker Chemie AG (DE) 2024-06-19 EP disclosed
WO-2023160814-A1 POLYORGANOSILOXANE COPOLYMERS WITH ORGANIC POLYMERS WACKER CHEMIE AG (DE) 2023-08-31 WO disclosed
WO-2023140263-A1 THERMALLY EXPANDABLE MICROSPHERES, HOLLOW PARTICLES, AND USE THEREOF 松本油脂製薬株式会社 2023-07-27 WO disclosed
WO-2023016649-A1 METAL-PLATED LAMINATES CONTAINING POLYORGANOSILOXANES WACKER CHEMIE AG (DE) 2023-02-16 WO disclosed
WO-2022004369-A1 MASTERBATCH FOR FOAM MOLDING AND USE THEREOF 松本油脂製薬株式会社 2022-01-06 WO disclosed
CN-110734601-A Liquid and meltable solid grade scorch-protected peroxides 阿科玛股份有限公司 2020-01-31 CN disclosed
WO-2020017361-A1 HEAT-EXPANDABLE MICROSPHERE AND USE THEREOF 松本油脂製薬株式会社 2020-01-23 WO disclosed
US-5298526-A Optically pure stereogenically labile 4-substituted-2-hydroxytetronic acids and pharmaceutical use THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1994-03-29 US disclosed
US-5204341-A Treating spasmodic disorders in gastro-enterology, in gynecology, in obsteretics and in urology ROUSSEL UCLAF (FR) 1993-04-20 US disclosed
US-5166271-A N-substituted maleimide with vinyl chloride graft polymerized MITSUI TOATSU CHEMICALS, INC. (JP) 1992-11-24 US disclosed
EP-0490765-A2 1-Arylsulfonyl-2-pyrrolidone-derivatives, process for their preparation, new in termediates, use for medicaments and drugs containing them ROUSSEL-UCLAF (FR) 1992-06-17 EP disclosed
US-5095126-A Efficient synthesis for optically pure stereogenically labile 4-substituted-2-hydroxytetronic acids OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1992-03-10 US disclosed
US-5028720-A 6,7-nonsubstituted and 6,7-disubstituted-3,4-dihydroxy benzopyran-2H-one compounds having antiaggregatory properties and processes for their preparation OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1991-07-02 US disclosed
EP-0359464-A2 Heat resistant polyvinyl chloride copolymer and preparation process of the copolymer MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-03-21 EP disclosed
US-4845121-A Aci-reductone compounds belonging to the 6,7-disubstituted-3,4-dihydro benzopyan-2H-one class having antiaggregatory properties THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1989-07-04 US disclosed
US-4645817-A PHASE TRANSFER CATALYSIS; COMPLEXES BAYER AKTIENGESELLSCHAFT (DE) 1987-02-24 US disclosed
US-3966414-A FREE-RADICAL SENSITIVE DYE, PEROXIDE BIO-MEDICAL SCIENCES, INC. (US) 1976-06-29 US disclosed