Malic Acid

Malic Acid

SCHEMBL2954331

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

nearest known ligand 0.46

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 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 2/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
EPHX2 P34913 1/20 0.32
OR51E2 Q9H255 1/20 0.31
TET2 Q6N021 3/20 0.30
TET3 O43151 1/20 0.30
TET1 Q8NFU7 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
Malic Acid SCHEMBL2955610 0.85 SMN1; SMN2 (0.46) SMN1; SMN2GAACYP4F2CYP4A11OR51E2
Malic Acid SCHEMBL2961462 0.84 SMN1; SMN2 (0.48) SMN1; SMN2EPHX2OR51E2TET2TET3
Malic Acid SCHEMBL2956485 0.84 SMN1; SMN2 (0.48) SMN1; SMN2GAACYP4F2CYP4A11
Malic Acid SCHEMBL2956598 0.84 SMN1; SMN2 (0.48) SMN1; SMN2GAACYP4F2CYP4A11ALDH1A1
Triethylene Glycol SCHEMBL2960132 0.84 SMN1; SMN2 (0.48) SMN1; SMN2EPHX2OR51E2TET2TET3
Cadaverine Tartrate SCHEMBL2955530 0.84 GAA (0.38) GAACYP4F2CYP4A11KDM4EALDH1A1
Succinic Acid SCHEMBL2963047 0.82 GAA (0.42) GAACYP4F2CYP4A11KDM4EALDH1A1
SCHEMBL2956605 0.81 SMN1; SMN2 (0.35) SMN1; SMN2GAAKDM4EALDH1A1EPHX2
Adipic Acid SCHEMBL2958565 0.81 GPR84 (0.50) GAACYP4F2CYP4A11ALDH1A1EPHX2
SCHEMBL2949576 0.80 MEN1 (0.41) SMN1; SMN2GAACYP4F2CYP4A11ALDH1A1

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 3802/4885GAA 4480/4885CYP4F2 1673/4885

“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.