Bicarbonate

Bicarbonate

SCHEMBL23201153

N#Cc1ccc(Cl)cc1CN.O=C(O)O.O=C(O)O

nearest known ligand 0.49

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 10)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.49
F2 P00734 1/20 0.48
NOS2 P35228 16/20 0.45
CYP2D6 P10635 4/20 0.45
SLC6A2 P23975 4/20 0.45
SLC6A4 P31645 4/20 0.45
NOS3 P29474 8/20 0.45
NOS1 P29475 8/20 0.45
VCAM1 P19320 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42

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
SCHEMBL23201070 0.91 NOS2 (0.50) ADRA1DF2NOS2NOS3NOS1
Trifluoroacetic Acid SCHEMBL28915050 0.90 ADRA1D (0.44) ADRA1DF2NOS2CYP2D6SLC6A2
SCHEMBL30711675 0.81 ADRA1D (0.47) ADRA1DF2NOS2CYP2D6SLC6A2
SCHEMBL27033537 0.81 ADRA1D (0.47) ADRA1DF2NOS2CYP2D6SLC6A2
SCHEMBL27033816 0.80 ADRA1D (0.52) ADRA1DF2NOS2CYP2D6SLC6A2
SCHEMBL30711627 0.80 ADRA1D (0.52) ADRA1DF2NOS2CYP2D6SLC6A2
Lithium Ion SCHEMBL30711636 0.79 ADRA1D (0.45) ADRA1DF2NOS2CYP2D6SLC6A2
Lithium Ion SCHEMBL29174263 0.79 ADRA1D (0.45) ADRA1DF2NOS2CYP2D6SLC6A2
SCHEMBL28571348 0.78 ADRA1D (0.50) ADRA1DF2NOS2CYP2D6SLC6A2
SCHEMBL23201171 0.78 F2 (0.46) ADRA1DF2NOS2NOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2023-05-11 US disclosed
US-11584714-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-02-21 US disclosed
EP-3802489-A2 MASP-2 INHIBITORS AND METHODS OF USE Omeros Corporation (US) 2021-04-14 EP 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 (2 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-11584714-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 ADRA1D 4576/4885F2 4188/4885NOS2 2617/4885
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 ADRA1D 4576/4885F2 4188/4885NOS2 2617/4885

“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.