SCHEMBL2953433

SCHEMBL2953433

CC(C)COC(C)COC(C)COC(=O)C(O)C(O)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.37
PGD P52209 2/20 0.34
TDP1 Q9NUW8 1/20 0.32
HTT P42858 1/20 0.31
TP53 P04637 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL1498062 0.91 TDP1 (0.42) TSHRPGDTDP1HTTTP53
SCHEMBL2964507 0.89 TSHR (0.34) TSHRPGDTDP1
SCHEMBL536566 0.89 TSHR (0.34) TSHRPGDTDP1
SCHEMBL535624 0.89 TDP1 (0.43) TSHRPGDTDP1HTTTP53
SCHEMBL2963069 0.88 TSHR (0.33) TSHRPGDHTT
SCHEMBL2962967 0.86 TDP1 (0.42) TSHRPGDTDP1
SCHEMBL30616867 0.86 TSHR (0.46) TSHRPGDHTTTP53ALDH1A1
SCHEMBL3979993 0.86 TSHR (0.46) TSHRPGDHTTTP53ALDH1A1
SCHEMBL3026591 0.82 TDP1 (0.34) TSHRPGDTDP1
SCHEMBL15512566 0.81 TSHR (0.40) TSHRPGDHTTTP53

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 3886/4885PGD 2259/4885TDP1 1628/4885
US-20100203003-A1 Oily Hair Cosmetics H1-0, H1-2, H1-3 TSHR 1973/4885PGD 3279/4885TDP1 2137/4885

“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.