SCHEMBL17201488

SCHEMBL17201488

CC(C)C(O)C(C)C(=O)n1c(=O)oc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.54
ALDH1A1 P00352 2/20 0.48
MAPT P10636 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ASAH1 Q13510 9/20 0.45
HPGD P15428 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPK1 P28482 2/20 0.41
USP2 O75604 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL5504041 0.87 IDO1 (0.50) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL5500885 0.87 IDO1 (0.50) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL5500883 0.87 IDO1 (0.50) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL5503210 0.85 IDO1 (0.50) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL5495840 0.85 IDO1 (0.54) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL5495838 0.85 IDO1 (0.54) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL5503209 0.85 IDO1 (0.50) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL6810615 0.83 IDO1 (0.49) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL6810618 0.83 IDO1 (0.49) IDO1ALDH1A1MAPTHSD17B10ASAH1
SCHEMBL5499815 0.83 IDO1 (0.49) IDO1ALDH1A1MAPTHSD17B10ASAH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746336-B2 Producing 3-hydroxycarboxylic acid and ketone using polyketide synthases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-09-05 US disclosed
US-11746336-B2 Producing 3-hydroxycarboxylic acid and ketone using polyketide synthases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-09-05 US disclosed
US-11746336-B2 Producing 3-hydroxycarboxylic acid and ketone using polyketide synthases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-09-05 US disclosed
US-20190345462-A1 Producing 3-Hydroxycarboxylic Acid and Ketone Using Polyketide Synthases UNITED STATES DEPARTMENT OF ENERGY 2019-11-14 US disclosed
US-20190345462-A1 Producing 3-Hydroxycarboxylic Acid and Ketone Using Polyketide Synthases UNITED STATES DEPARTMENT OF ENERGY 2019-11-14 US disclosed
US-10233431-B2 Producing 3-hydroxycarboxylic acid and ketone using polyketide synthases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-03-19 US disclosed
US-10233431-B2 Producing 3-hydroxycarboxylic acid and ketone using polyketide synthases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-03-19 US disclosed
US-20150307855-A1 Producing 3-Hydroxycarboxylic Acid and Ketone Using Polyketide Synthases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-10-29 US disclosed
US-20150307855-A1 Producing 3-Hydroxycarboxylic Acid and Ketone Using Polyketide Synthases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-10-29 US disclosed
US-20150307855-A1 Producing 3-Hydroxycarboxylic Acid and Ketone Using Polyketide Synthases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-10-29 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 (3 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-20190345462-A1 Producing 3-Hydroxycarboxylic Acid and Ketone Using Polyketide Synthases COASY, FASN, DHPS IDO1 2652/4885ALDH1A1 1555/4885MAPT 4148/4885
US-11746336-B2 Producing 3-hydroxycarboxylic acid and ketone using polyketide synthases COASY, FASN, DHPS IDO1 2652/4885ALDH1A1 1555/4885MAPT 4148/4885
US-10233431-B2 Producing 3-hydroxycarboxylic acid and ketone using polyketide synthases COASY, FASN, DHPS IDO1 2652/4885ALDH1A1 1555/4885MAPT 4148/4885

“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.