SCHEMBL2962827

SCHEMBL2962827

CCOCCOC(=O)C(O)CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TSHR P16473 1/20 0.50
THRB P10828 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.34
GPR84 Q9NQS5 4/20 0.32

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
SCHEMBL2964325 0.98 ALDH1A1 (0.48) ALDH1A1TSHRTHRBSMN1; SMN2HSD17B10
SCHEMBL2956491 0.87 SMN1; SMN2 (0.38) ALDH1A1TSHRSMN1; SMN2GPR84
SCHEMBL2953491 0.87 SMN1; SMN2 (0.40) ALDH1A1TSHRSMN1; SMN2HSD17B10SLC22A6
SCHEMBL2964148 0.87 SMN1; SMN2 (0.40) ALDH1A1TSHRSMN1; SMN2HSD17B10SLC22A6
SCHEMBL10404855 0.84 ALDH1A1 (0.46) ALDH1A1TSHRTHRBSMN1; SMN2HSD17B10
SCHEMBL10405395 0.82 ALDH1A1 (0.44) ALDH1A1TSHRTHRBSMN1; SMN2HSD17B10
Ether SCHEMBL2953490 0.82 SMN1; SMN2 (0.36) ALDH1A1TSHRSMN1; SMN2SLC22A6GPR84
SCHEMBL1561848 0.82 SMN1; SMN2 (0.46) ALDH1A1SMN1; SMN2SLC22A6GPR84
SCHEMBL2953324 0.81 SMN1; SMN2 (0.39) ALDH1A1TSHRSMN1; SMN2HSD17B10SLC22A6
SCHEMBL10404853 0.81 ALDH1A1 (0.47) ALDH1A1TSHRTHRBHSD17B10

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 ALDH1A1 81/4885TSHR 3886/4885THRB 3372/4885

“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.