Salicylic Acid

Salicylic Acid

SCHEMBL3879225

O=C(O)c1ccccc1OCc1ccccc1O.O=C([O-])c1ccccc1O.[Na+]

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHE

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
KDM4E B2RXH2 4/20 0.56
HPGD P15428 3/20 0.56
HTT P42858 2/20 0.52
TP53 P04637 1/20 0.52
HSD17B10 Q99714 1/20 0.50
KMT2A Q03164 3/20 0.48
PTK2B Q14289 1/20 0.48
MCL1 Q07820 3/20 0.47
FOLH1 Q04609 2/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
HMGB1 P09429 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA7 P43166 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CA9 Q16790 1/20 0.46
NAPRT Q6XQN6 1/20 0.46

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
Salicylic Acid SCHEMBL30476656 0.91 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDHTTTP53
Salicylic Acid SCHEMBL31052931 0.91 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDHTTTP53
SCHEMBL38459 0.91 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDHTTTP53
SCHEMBL27344933 0.90 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDHTTTP53
SCHEMBL27320205 0.90 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDHTTTP53
SCHEMBL11792088 0.87 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHTTTP53
Salicylamide SCHEMBL28057428 0.86 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDHTTTP53
SCHEMBL2467710 0.83 KDM4E (0.66) ALDH1A1KDM4EHPGDHTTTP53
SCHEMBL27914372 0.80 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHTTTP53
Salsalate SCHEMBL3879224 0.78 KDM4E (0.82) ALDH1A1KDM4EHPGDHSD17B10KMT2A

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
EP-2107909-A2 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF LIVER DISORDERS IDENIX Pharmaceuticals, Inc. (US) 2009-10-14 EP disclosed
US-20080261913-A1 Phosphoroamidate conjugated to therapeutic agent such as Aclarubicin; nucleoside derivatives; S-pivaloyl-2-thioethyl phosphoroamidate; liver cancer, inflammation, fibrosis, metabolic disorders IDENIX PHARMACEUTICALS, INC. 2008-10-23 US disclosed
WO-2008082602-A2 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF LIVER DISORDERS IDENIX PHARMACEUTICALS, INC. (US) 2008-07-10 WO 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-20080261913-A1 Phosphoroamidate conjugated to therapeutic agent such as Aclarubicin; nucleoside derivatives; S-pivaloyl-2-thioethyl phosphoroamidate; liver cancer, inflammation, fibrosis, metabolic disorders NTPCR, PNP, TYMP ALDH1A1 2818/4885KDM4E 2653/4885HPGD 3628/4885

“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.