Citric Acid

Citric Acid

SCHEMBL132575

O.O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Ca+2].[Ca+2].[Ca+2]

nearest known ligand 0.84

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BHRH2IMPA1

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

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA4 P22748 3/20 0.84
ALDH1A1 P00352 1/20 0.32
CASP1 P29466 1/20 0.30

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
Citric Acid SCHEMBL372577 1.00 CA4 (0.84) CA4ALDH1A1CASP1
Citric Acid SCHEMBL372574 1.00 CA4 (0.84) CA4ALDH1A1CASP1
Citric Acid SCHEMBL372480 1.00 CA4 (0.84) CA4ALDH1A1CASP1
Citric Acid SCHEMBL28575943 1.00 CA4 (0.84) CA4ALDH1A1CASP1
Citric Acid SCHEMBL2460192 1.00 CA4 (0.84) CA4ALDH1A1CASP1
Citric Acid SCHEMBL372478 1.00 CA4 (0.84) CA4ALDH1A1CASP1
Citric Acid SCHEMBL372195 1.00 CA4 (0.84) CA4ALDH1A1CASP1
Citric Acid SCHEMBL163778 1.00 CA4 (0.84) CA4ALDH1A1CASP1
Citric Acid SCHEMBL23012792 0.97 CA4 (0.89) CA4ALDH1A1CASP1
Citric Acid SCHEMBL8845344 0.97 CA4 (0.89) CA4ALDH1A1CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118891028-A Oral care compositions, methods and kits 舒万诺知识产权公司 2024-11-01 CN claimed
US-20190216814-A1 LIQUID FORMULATIONS OF (S)-N-(5-((R)-2-(2,5-DIFLUOROPHENYL)-PYRROLIDIN-1-YL)-PYRAZOLO[1,5-A]PYRIMIDIN-3-YL)-3-HYDROXYPYRROLIDINE-1-CARBOXAMIDE LOXO ONCOLOGY, INC. 2019-07-18 US claimed
CN-109414442-A (S) liquid preparation of-N- (5- ((R) -2- (2,5- difluorophenyl)-pyrrolidin-1-yl)-pyrazolo [1,5-A] pyrimidin-3-yl) -3- hydroxyl pyrrolidine -1- formamide 洛克索肿瘤学股份有限公司 2019-03-01 CN claimed
EP-3439662-A1 LIQUID FORMULATIONS OF (S)-N-(5-((R)-2-(2,5-DIFLUOROPHENYL)-PYRROLIDIN-1-YL)-PYRAZOLO[1,5-A]PYRIMIDIN-3-YL)-3-HYDROXYPYRROLIDINE-1-CARBOXAMIDE Loxo Oncology Inc. (US) 2019-02-13 EP claimed
EP-3439663-A1 METHODS OF TREATING PEDIATRIC CANCERS Loxo Oncology Inc. (US) 2019-02-13 EP claimed
CN-109310694-A METHODS OF TREATING PEDIATRIC CANCERS 洛克索肿瘤学股份有限公司 2019-02-05 CN claimed
US-10137127-B2 Liquid formulations of (S)-N-(5-((R)-2-(2,5-difluorophenyl)-pyrrolidin-1-yl)-pyrazolo[1,5-A]pyrimidin-3-yl)-3-hydroxypyrrolidine-1-carboxamide LOXO ONCOLOGY, INC. (US) 2018-11-27 US claimed
US-20170296544-A1 LIQUID FORMULATIONS OF (S)-N-(5-((R)-2-(2,5-DIFLUOROPHENYL)-PYRROLIDIN-1-YL)-PYRAZOLO[1,5-A]PYRIMIDIN-3-YL)-3-HYDROXYPYRROLIDINE-1-CARBOXAMIDE LOXO ONCOLOGY, INC. 2017-10-19 US claimed
WO-2017176744-A1 METHODS OF TREATING PEDIATRIC CANCERS LOXO ONCOLOGY, INC. (US) 2017-10-12 WO claimed
WO-2017176751-A1 LIQUID FORMULATIONS OF (S)-N-(5-((R)-2-(2,5-DIFLUOROPHENYL)-PYRROLIDIN-1-YL)-PYRAZOLO[1,5-A]PYRIMIDIN-3-YL)-3-HYDROXYPYRROLIDINE-1-CARBOXAMIDE LOXO ONCOLOGY, INC. (US) 2017-10-12 WO claimed
CN-101172104-A Processes of making and using pharmaceutical formulations of antineoplastic agents SCHERING CORP (US) 2008-05-07 CN claimed
CN-100346784-C pharmaceutical formulations of antineoplastic agents, in particular temozolomide, preparation method and use thereof SCHERING CORP (US) 2007-11-07 CN claimed
EP-1838307-A1 METHODS OF USING TEMOZOLOMIDE FORMULATION INTRATHECALLY IN THE TREATMENT OF CANCERS SCHERING CORPORATION (US) 2007-10-03 EP claimed
WO-2006060464-A1 METHODS OF USING TEMOZOLOMIDE FORMULATION INTRATHECALLY IN THE TREATMENT OF CANCERS SCHERING CORPORATION (US) 2006-06-08 WO claimed
US-20060122162-A1 Methods of using temozolomide formulation intrathecally in the treatment of cancers SCHERING CORPORATION 2006-06-08 US claimed
US-6987108-B2 Pharmaceutical formulations of antineoplastic agents and processes of making and using the same SCHERING CORPORATION (US) 2006-01-17 US claimed
CN-1635871-A pharmaceutical formulations of antineoplastic agents, in particular temozolomide, preparation method and use thereof SCHERING CORP (US) 2005-07-06 CN claimed
EP-1478339-A1 PHARMACEUTICAL FORMULATIONS OF ANTINEOPLASTIC AGENTS, IN PARTICULAR TEMOZOLOMIDE, PROCESSES OF MAKING AND USING THE SAME SCHERING CORPORATION (US) 2004-11-24 EP claimed
US-20040043001-A1 Pharmaceutical formulations of antineoplastic agents and processes of making and using the same SCHERING CORPORATION 2004-03-04 US claimed
WO-2003072082-A1 PHARMACEUTICAL FORMULATIONS OF ANTINEOPLASTIC AGENTS, IN PARTICULAR TEMOZOLOMIDE, PROCESSES OF MAKING AND USING THE SAME SCHERING CORPORATION (US) 2003-09-04 WO claimed

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

For each of this compound's patents that has machine-readable text (5 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-20190216814-A1 LIQUID FORMULATIONS OF (S)-N-(5-((R)-2-(2,5-DIFLUOROPHENYL)-PYRROLIDIN-1-YL)-PYRAZOLO[1,5-A]PYRIMIDIN-3-YL)-3-HYDROXYPYRROLIDINE-1-CARBOXAMIDE IL5, IL1A, RRP15 CA4 4402/4885ALDH1A1 1446/4885CASP1 173/4885
US-10137127-B2 Liquid formulations of (S)-N-(5-((R)-2-(2,5-difluorophenyl)-pyrrolidin-1-yl)-pyrazolo[1,5-A]pyrimidin-3-yl)-3-hydroxypyrrolidine-1-carboxamide IL5, IL1A, RRP15 CA4 4402/4885ALDH1A1 1446/4885CASP1 173/4885
US-20040043001-A1 Pharmaceutical formulations of antineoplastic agents and processes of making and using the same ASNS, TP53, QPCTL CA4 2466/4885ALDH1A1 3247/4885CASP1 2019/4885
US-20170296544-A1 LIQUID FORMULATIONS OF (S)-N-(5-((R)-2-(2,5-DIFLUOROPHENYL)-PYRROLIDIN-1-YL)-PYRAZOLO[1,5-A]PYRIMIDIN-3-YL)-3-HYDROXYPYRROLIDINE-1-CARBOXAMIDE IL5, IL1A, RRP15 CA4 4402/4885ALDH1A1 1446/4885CASP1 173/4885
US-20060122162-A1 Methods of using temozolomide formulation intrathecally in the treatment of cancers PMP22, TUBB2A, TUBB6 CA4 678/4885ALDH1A1 1296/4885CASP1 1774/4885

“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.