SCHEMBL2962392

SCHEMBL2962392

CC(C)OC(C)C.O=C(CC(O)C(=O)O)OCCO

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.38
OR51E2 Q9H255 1/20 0.34
TET2 Q6N021 3/20 0.33
TET3 O43151 1/20 0.33
TET1 Q8NFU7 1/20 0.33
ALDH1A1 P00352 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 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
Ethylene SCHEMBL2962367 0.97 SMN1; SMN2 (0.35) SMN1; SMN2OR51E2TET2TET3TET1
Propene SCHEMBL2961759 0.92 TSHR (0.36) SMN1; SMN2TET2TET3TET1
SCHEMBL3024727 0.91 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL15282112 0.89 SMN1; SMN2 (0.46) SMN1; SMN2OR51E2TET2TET3TET1
Ether SCHEMBL2962826 0.83 ALDH1A1 (0.39) SMN1; SMN2OR51E2TET2TET3TET1
Ether SCHEMBL2964323 0.80 ALDH1A1 (0.36) SMN1; SMN2OR51E2TET2TET3TET1
Malic Acid SCHEMBL2962373 0.79 SMN1; SMN2 (0.52) SMN1; SMN2OR51E2TET2TET3TET1
SCHEMBL28065452 0.79 MEN1 (0.41) SMN1; SMN2OR51E2TET2TET3TET1
SCHEMBL28085427 0.77 SMN1; SMN2 (0.41) SMN1; SMN2OR51E2TET2TET3TET1
Ether SCHEMBL2958831 0.76 TSHR (0.36) SMN1; SMN2TET2TET3TET1ALDH1A1

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-2392314-B1 OILY HAIR COSMETIC KOKYU ALCOHOL KOGYO CO LTD (JP) 2019-08-14 EP disclosed
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 3802/4885OR51E2 952/4885TET2 180/4885

“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.