Malic Acid

Malic Acid

SCHEMBL2956485

CCCOCCCCOCCCCO.O=C(O)CC(O)C(=O)O.OCCCCOCCCCO

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1SDRD2HTR1BHTR1DHTR1F

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

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.48
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.37
GPR84 Q9NQS5 7/20 0.37
FFAR1 O14842 1/20 0.37
GAA P10253 1/20 0.36
ACHE P22303 4/20 0.34

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
Malic Acid SCHEMBL2956598 0.90 SMN1; SMN2 (0.48) SMN1; SMN2CYP4F2CYP4A11MEN1THRB
Malic Acid SCHEMBL2964150 0.88 SMN1; SMN2 (0.54) SMN1; SMN2MEN1THRBHTTKMT2A
Triethylene Glycol SCHEMBL2953129 0.87 SMN1; SMN2 (0.52) SMN1; SMN2MEN1THRBHTTKMT2A
Malic Acid SCHEMBL2963355 0.87 SMN1; SMN2 (0.52) SMN1; SMN2MEN1THRBHTTKMT2A
Malic Acid SCHEMBL28182365 0.85 SMN1; SMN2 (0.54) SMN1; SMN2MEN1THRBHTTKMT2A
Malic Acid SCHEMBL2954331 0.84 SMN1; SMN2 (0.46) SMN1; SMN2CYP4F2CYP4A11GAA
Malic Acid SCHEMBL2955610 0.84 SMN1; SMN2 (0.46) SMN1; SMN2CYP4F2CYP4A11USP2GAA
Malic Acid SCHEMBL8977105 0.84 TSHR (0.55) SMN1; SMN2MEN1THRBHTTKMT2A
Cadaverine Tartrate SCHEMBL2958920 0.83 CYP4F2 (0.42) CYP4F2CYP4A11MEN1THRBHTT
Malic Acid SCHEMBL17841691 0.81 SMN1; SMN2 (0.58) SMN1; SMN2MEN1KMT2ATSHRGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7766978-B2 Acidic hair dyeing method KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2010-08-03 US disclosed
US-20090100609-A1 ACIDIC HAIR DYE COMPOSITION KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2009-04-23 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-20090100609-A1 ACIDIC HAIR DYE COMPOSITION H1-0, MRM1, H1-4 SMN1; SMN2 3802/4885CYP4F2 1673/4885CYP4A11 1151/4885

“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.