SCHEMBL2949939

SCHEMBL2949939

CCCOC(C)COC(C)COC(=O)CCC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
LMNA P02545 3/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
ATM Q13315 1/20 0.35
KDM6B O15054 1/20 0.34
KDM5C P41229 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
PAM P19021 2/20 0.34
KDM4E B2RXH2 1/20 0.34
DUSP3 P51452 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FFAR3 O14843 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33

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
SCHEMBL2955464 0.91 MAPT (0.47) MAPTTDP1LMNAALDH1A1CYP3A4
SCHEMBL20602786 0.91 MAPT (0.44) MAPTTDP1LMNAALDH1A1CYP3A4
SCHEMBL12971221 0.87 MAPT (0.39) MAPTTDP1LMNAALDH1A1CYP3A4
SCHEMBL2964123 0.87 MAPT (0.38) MAPTTDP1LMNAALDH1A1CYP3A4
SCHEMBL2955154 0.86 EGLN1 (0.38) MAPTTDP1LMNAALDH1A1CYP3A4
SCHEMBL17377704 0.83 MAPT (0.50) MAPTTDP1LMNAALDH1A1CYP3A4
SCHEMBL11290294 0.83 TDP1 (0.43) MAPTTDP1LMNAALDH1A1CYP3A4
SCHEMBL2958915 0.82 EGLN1 (0.35) MAPTLMNAALDH1A1KDM6BKDM5C
SCHEMBL25272199 0.82 MAPT (0.53) MAPTTDP1LMNAALDH1A1TSHR
Butane SCHEMBL2855806 0.79 MAPT (0.46) MAPTTDP1LMNAALDH1A1CYP3A4

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 MAPT 4627/4885TDP1 1628/4885LMNA 1060/4885
US-20100203003-A1 Oily Hair Cosmetics H1-0, H1-2, H1-3 MAPT 4080/4885TDP1 2137/4885LMNA 2262/4885

“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.