SCHEMBL25944276

SCHEMBL25944276

CCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.44
TSHR P16473 3/20 0.42
CYP3A4 P08684 1/20 0.41
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
RARB P10826 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
PLA2G4B P0C869 3/20 0.36
CTSK P43235 1/20 0.35
ATM Q13315 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL10825304 1.00 CES2 (0.44) CES2TSHRCYP3A4MEN1THRB
SCHEMBL20129293 1.00 CES2 (0.44) CES2TSHRCYP3A4MEN1THRB
SCHEMBL9660288 1.00 CES2 (0.44) CES2TSHRCYP3A4MEN1THRB
SCHEMBL18551080 0.98 CES2 (0.43) CES2TSHRCYP3A4MEN1THRB
SCHEMBL17947432 0.96 CES2 (0.49) CES2TSHRCYP3A4MEN1THRB
SCHEMBL18591856 0.96 CES2 (0.44) CES2TSHRCYP3A4MEN1THRB
SCHEMBL5607231 0.96 CES2 (0.47) CES2TSHRCYP3A4ALDH1A1PSEN1
SCHEMBL17951936 0.95 CES2 (0.47) CES2TSHRCYP3A4MEN1THRB
SCHEMBL17951942 0.95 CES2 (0.47) CES2TSHRCYP3A4MEN1THRB
SCHEMBL17951967 0.95 CES2 (0.52) CES2TSHRCYP3A4MEN1THRB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230241242-A1 PREPARATION METHOD FOR ANTIBODY MEDICAMENT CONJUGATE JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2023-08-03 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-20230241242-A1 PREPARATION METHOD FOR ANTIBODY MEDICAMENT CONJUGATE FCGR1A, FCGR3B, FCGR2A CES2 148/4885TSHR 904/4885CYP3A4 1255/4885

“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.