SCHEMBL9750896

SCHEMBL9750896

CCC(C)CCCCCOCCCCCC(C)CC

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
LMNA P02545 1/20 0.36
SPHK1 Q9NYA1 1/20 0.33
USP2 O75604 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
TSHR P16473 1/20 0.32
CYP3A4 P08684 1/20 0.31
CES2 O00748 1/20 0.31
PLA2G2C Q5R387 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
SCHEMBL17103147 0.97 LMNA (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL18512715 0.93 HTT (0.43) HTTMEN1THRBKMT2AMAPT
SCHEMBL12354883 0.93 HTT (0.43) HTTMEN1THRBKMT2AMAPT
SCHEMBL18512391 0.93 HTT (0.39) HTTMEN1THRBKMT2AMAPT
SCHEMBL18511894 0.93 HTT (0.39) HTTMEN1THRBKMT2AMAPT
SCHEMBL25479121 0.92 MEN1 (0.34) HTTMEN1THRBKMT2AMAPT
SCHEMBL7521849 0.90 TSHR (0.35) HTTMEN1THRBKMT2AMAPT
SCHEMBL15732743 0.89 CYP3A4 (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL15732762 0.89 CYP3A4 (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL22268814 0.89 CYP3A4 (0.38) HTTMEN1THRBKMT2AMAPT

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
US-11186531-B2 Production method for alkene KUREHA CORPORATION (JP) 2021-11-30 US disclosed
US-20210047252-A1 PRODUCTION METHOD FOR ALKENE KUREHA CORPORATION (JP) 2021-02-18 US disclosed
EP-0284005-B1 METHOD OF PRODUCTION OF POLYOLEFINS IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1991-12-18 EP disclosed
US-4981930-A POLYMERIZATION CATALYSTS IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1991-01-01 US disclosed
EP-0284005-A2 Method of production of polyolefins IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1988-09-28 EP 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-20210047252-A1 PRODUCTION METHOD FOR ALKENE ALK, ALKBH3, ALKBH1 HTT 1655/4885MEN1 4564/4885THRB 4240/4885
US-11186531-B2 Production method for alkene ALK, ALKBH3, ALKBH1 HTT 1655/4885MEN1 4564/4885THRB 4240/4885

“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.