SCHEMBL2465449

SCHEMBL2465449

NCCn1cc(CC(=O)O)c2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.68
MCL1 Q07820 4/20 0.60
PLK1 P53350 5/20 0.56
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
ICMT O60725 1/20 0.56
HTR6 P50406 1/20 0.54
CREBBP Q92793 1/20 0.51
TBXAS1 P24557 1/20 0.49
TERT O14746 3/20 0.47

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
SCHEMBL29379289 0.91 CDC25A (0.68) CDC25AMCL1PLK1ALDH1A1LMNA
SCHEMBL10965765 0.88 ICMT (0.71) CDC25AMCL1ICMTHTR6
SCHEMBL29376139 0.86 CDC25A (0.67) CDC25AMCL1PLK1ALDH1A1LMNA
SCHEMBL15747715 0.86 CDC25A (0.80) CDC25AMCL1PLK1ALDH1A1LMNA
SCHEMBL28840792 0.85 CDC25A (0.73) CDC25AMCL1PLK1ALDH1A1LMNA
SCHEMBL28370235 0.85 CDC25A (0.73) CDC25AMCL1PLK1ALDH1A1LMNA
SCHEMBL18180209 0.84 CDC25A (0.63) CDC25AMCL1PLK1ALDH1A1LMNA
SCHEMBL15747729 0.84 CDC25A (0.90) CDC25AMCL1PLK1ALDH1A1LMNA
SCHEMBL2945684 0.83 CDC25A (0.63) CDC25AMCL1PLK1ALDH1A1LMNA
SCHEMBL3743075 0.83 CDC25A (0.70) CDC25AMCL1PLK1ALDH1A1LMNA

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-8481587-B2 Substituted 2-(5-hydroxy-2-methyl-1H-indole-3-yl)acetic acids and ethers thereof and the use of same to treat viral diseases IVASHCHENKO ANDREY ALEXANDROVICH (RU) 2013-07-09 US disclosed
US-20110230524-A1 SUBSTITUTED 2-(5-HYDROXY-2-METHYL-1H-INDOLE-3-YL)ACETIC ACIDS AND ETHERS THEREOF AND THE USE OF SAME TO TREAT VIRAL DISEASES ALLA CHEM, LLC. 2011-09-22 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-20110230524-A1 SUBSTITUTED 2-(5-HYDROXY-2-METHYL-1H-INDOLE-3-YL)ACETIC ACIDS AND ETHERS THEREOF AND THE USE OF SAME TO TREAT VIRAL DISEASES IDO1, TPH1, FOXM1 CDC25A 691/4885MCL1 1202/4885PLK1 4604/4885

“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.