Bicarbonate

Bicarbonate

SCHEMBL14662802

CC1CC2=C1CCCC2.O=C(O)O

nearest known ligand 0.36

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 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA4 P22748 1/20 0.32
▸ KMT2A Q03164 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL21663431 0.67 KDM4E (0.33) KDM4EPOLBL3MBTL1
SCHEMBL31265523 0.67 CA1 (0.37) CA1CA2CA4KMT2A
SCHEMBL31113358 0.67 — —
SCHEMBL31113396 0.62 CA1 (0.38) CA1CA2CA4KMT2A
SCHEMBL8419229 0.61 KMT2A (0.40) CA1CA2CA4KMT2AALDH1A1
SCHEMBL21940584 0.58 CA1 (0.33) CA1CA2CA4KMT2A
SCHEMBL11054767 0.57 KMT2A (0.35) CA1CA2CA4KMT2ATDP1
SCHEMBL3926378 0.57 — —
Bicarbonate SCHEMBL10617200 0.56 — —
Cyclopentanone SCHEMBL8542126 0.56 TRIM24 (0.71) KDM4EPOLBL3MBTL1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140171616-A1 SELF-ADHESIVE COMPOSITION AND SELF-ADHESIVE FILM FOR GLASS MANUFACTURED THEREFROM SK GLOBAL CHEMICAL CO., LTD. (KR) 2014-06-19 — — US claimed
EP-2736997-A1 SELF-ADHESIVE COMPOSITION AND SELF-ADHESIVE FILM FOR GLASS MANUFACTURED THEREFROM SK Innovation Co., Ltd. (KR) 2014-06-04 — — EP claimed
WO-2013015522-A1 SELF-ADHESIVE COMPOSITION AND SELF-ADHESIVE FILM FOR GLASS MANUFACTURED THEREFROM SK INNOVATION CO.,LTD. (KR) 2013-01-31 — — WO claimed
US-9018318-B2 Catalysts for the preparation of carbonates from epoxides and CO2 BASF SE Corporation (DE) 2015-04-28 — — US disclosed
US-20140171616-A1 SELF-ADHESIVE COMPOSITION AND SELF-ADHESIVE FILM FOR GLASS MANUFACTURED THEREFROM SK GLOBAL CHEMICAL CO., LTD. (KR) 2014-06-19 — — US disclosed
EP-2736997-A1 SELF-ADHESIVE COMPOSITION AND SELF-ADHESIVE FILM FOR GLASS MANUFACTURED THEREFROM SK Innovation Co., Ltd. (KR) 2014-06-04 — — EP disclosed
US-20130060001-A1 CATALYSTS FOR THE PREPARATION OF CARBONATES FROM EPOXIDES AND CO2 BASF SE (DE) 2013-03-07 — — US disclosed
WO-2013015522-A1 SELF-ADHESIVE COMPOSITION AND SELF-ADHESIVE FILM FOR GLASS MANUFACTURED THEREFROM SK INNOVATION CO.,LTD. (KR) 2013-01-31 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130060001-A1 CATALYSTS FOR THE PREPARATION OF CARBONATES FROM EPOXIDES AND CO2 TPRKB, PKD1, MCCC2 KDM4E 218/4885POLB 1366/4885L3MBTL1 4482/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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