SCHEMBL2960158

SCHEMBL2960158

CC(C)COCCOCCOC(=O)C(O)C(O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPY1R P25929 1/20 0.32
NPY2R P49146 1/20 0.32
PMP22 Q01453 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HSD17B10 Q99714 2/20 0.31
PGD P52209 1/20 0.31
ALDH1A1 P00352 3/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HTT P42858 1/20 0.31
CYP2C9 P11712 1/20 0.31
PDE4A P27815 1/20 0.31

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
SCHEMBL2962715 0.98 TSHR (0.37) TSHRMEN1KMT2ANPY1RNPY2R
SCHEMBL2961730 0.90 TSHR (0.33) TSHRALDH1A1L3MBTL1HTT
Cadaverine Tartrate SCHEMBL2962747 0.84 MEN1 (0.41) TSHRMEN1KMT2APMP22HSD17B10
Cadaverine Tartrate SCHEMBL2953336 0.84 MEN1 (0.41) TSHRMEN1KMT2APMP22HSD17B10
SCHEMBL2962959 0.82 TSHR (0.36) TSHRMEN1KMT2AHSD17B10PGD
SCHEMBL2959188 0.81 TSHR (0.50) TSHRMEN1KMT2AHSD17B10ALDH1A1
SCHEMBL2953313 0.81 TSHR (0.39) TSHRMEN1KMT2APMP22TDP1
SCHEMBL2960204 0.81 TSHR (0.39) TSHRMEN1KMT2APMP22TDP1
SCHEMBL30616867 0.81 TSHR (0.46) TSHRPGDALDH1A1TP53HTT
SCHEMBL3979993 0.81 TSHR (0.46) TSHRPGDALDH1A1TP53HTT

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 5 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-8562957-B2 Oily hair cosmetics KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2013-10-22 US disclosed
US-20100203003-A1 Oily Hair Cosmetics KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2010-08-12 US 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 (2 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 TSHR 3886/4885MEN1 157/4885KMT2A 2163/4885
US-20100203003-A1 Oily Hair Cosmetics H1-0, H1-2, H1-3 TSHR 1973/4885MEN1 85/4885KMT2A 842/4885

“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.