SCHEMBL10029375

SCHEMBL10029375

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 2/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
SLC1A1 P43005 1/20 0.33
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 2/20 0.32
SLC13A5 Q86YT5 7/20 0.32
MAPT P10636 1/20 0.31
SLC13A2 Q13183 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
SCHEMBL15806369 1.00 MEN1 (0.41) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL15031322 0.86 L3MBTL1 (0.41) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL16254847 0.86 L3MBTL1 (0.41) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL12745455 0.84 L3MBTL1 (0.40) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL13059735 0.81 MAPT (0.40) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL14600621 0.81 MAPT (0.40) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL10029372 0.81 ALDH1A1 (0.56) L3MBTL1ALDH1A1LMNACYP2D6CYP2C19
SCHEMBL23331 0.80 ALDH1A1 (0.52) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL12746071 0.80 L3MBTL1 (0.37) MEN1HPGDRECQLKMT2AHSD17B10
SCHEMBL12745724 0.79 HSD17B10 (0.38) MEN1HPGDRECQLKMT2AHSD17B10

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-20140343039-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2014-11-20 US disclosed
US-20140343039-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2014-11-20 US disclosed
US-20120022250-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2012-01-26 US disclosed
US-20120022250-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2012-01-26 US disclosed
WO-2010103405-A2 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2010-09-16 WO 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-20120022250-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS CHRM1, OPRM1, CHRM2 MEN1 3409/4885HPGD 2118/4885RECQL 1117/4885
US-20140343039-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS CFH, C5, CHRM1 MEN1 3084/4885HPGD 2297/4885RECQL 1905/4885

“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.