Malonic Acid

Malonic Acid

SCHEMBL15710285

CCNCC.CC[Na].O=C(O)CC(=O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CCKAR

The experimentally established mechanism targets of Malonic Acid. 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
LDHA P00338 1/20 0.50
SRR Q9GZT4 1/20 0.50
TP53 P04637 1/20 0.44
FFAR3 O14843 2/20 0.40
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
MCL1 Q07820 1/20 0.31
AKR1B1 P15121 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
Malonic Acid SCHEMBL5874776 0.91 LDHA (0.60) LDHASRRTP53FFAR3HDAC3
Malonic Acid SCHEMBL5874780 0.91 LDHA (0.60) LDHASRRTP53FFAR3HDAC3
Malonic Acid SCHEMBL15710925 0.90 LDHA (0.45) LDHASRRTP53FFAR3HDAC3
Malonic Acid SCHEMBL9635789 0.88 LDHA (0.64) LDHASRRFFAR3HDAC3HDAC1
Malonic Acid SCHEMBL15711068 0.82 LDHA (0.56) LDHASRRFFAR3HDAC3HDAC1
Malonic Acid SCHEMBL15710339 0.82 LDHA (0.56) LDHASRRFFAR3HDAC3HDAC1
Diethylamine SCHEMBL27846018 0.80 TP53 (0.47) LDHASRRTP53FFAR3HDAC3
Diethylamine SCHEMBL27846019 0.80 TP53 (0.47) LDHASRRTP53FFAR3HDAC3
Propionic Acid SCHEMBL1014332 0.79 FFAR3 (0.67) LDHASRRTP53FFAR3HDAC3
Propionic Acid SCHEMBL28428410 0.79 FFAR3 (0.67) LDHASRRTP53FFAR3HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2740738-B1 PLATINUM COMPOUNDS FOR TREATING CELL PROLIFERATIVE DISEASE, PREPARATION METHODS AND USES THEREOF BEIJING FSWELCOME TECH DEVELOPMENT CO LTD (CN) 2018-03-28 EP disclosed
US-9138421-B2 Platinum compounds for treating cell proliferative diseases, preparation method and use thereof BEIJING FSWELCOME TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2015-09-22 US disclosed
EP-2740738-A1 PLATINUM COMPOUNDS FOR TREATING CELL PROLIFERATIVE DISEASE, PREPARATION METHODS AND USES THEREOF Beijing FSwelcome Technology Development Co., Ltd. (CN) 2014-06-11 EP disclosed
US-20140142079-A1 PLATINUM COMPOUNDS FOR TREATING CELL PROLIFERATIVE DISEASES, PREPARATION METHOD AND USE THEREOF BEIJING FSWELCOME TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2014-05-22 US 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-20140142079-A1 PLATINUM COMPOUNDS FOR TREATING CELL PROLIFERATIVE DISEASES, PREPARATION METHOD AND USE THEREOF PCNA, POLI, MKI67 LDHA 135/4885SRR 2142/4885TP53 6/4885

“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.