SCHEMBL4665329

SCHEMBL4665329

CCOC(=O)C=Cc1cccc(NC(C)=O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.55
DPP4 P27487 1/20 0.55
MAPT P10636 5/20 0.52
LMNA P02545 3/20 0.52
TP53 P04637 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
ALDH1A1 P00352 2/20 0.52
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
MEN1 O00255 6/20 0.51
KMT2A Q03164 6/20 0.51
NPSR1 Q6W5P4 2/20 0.51
XBP1 P17861 1/20 0.51
MAPK1 P28482 1/20 0.51

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
SCHEMBL4665327 1.00 TTR (0.55) TTRDPP4MAPTLMNATP53
SCHEMBL10895023 0.86 SIRT2 (0.57) TTRMAPTLMNATP53SMN1; SMN2
SCHEMBL7769917 0.85 TTR (0.56) TTRDPP4MAPTNPC1RAB9A
SCHEMBL4427602 0.84 TTR (0.69) TTRDPP4MAPTLMNATP53
SCHEMBL4427604 0.84 TTR (0.69) TTRDPP4MAPTLMNATP53
SCHEMBL10262541 0.84 HDAC3 (0.54) TTRDPP4MAPTLMNASMN1; SMN2
SCHEMBL2630687 0.84 PKM (0.56) TTRDPP4MAPTLMNATP53
SCHEMBL6984318 0.83 CA12 (0.65) TTRDPP4MAPTLMNATP53
SCHEMBL6984316 0.83 CA12 (0.65) TTRDPP4MAPTLMNATP53
SCHEMBL27414274 0.83 TTR (0.53) TTRDPP4MAPTTP53NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275274-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED COMPOUNDS DSM IP ASSETS B.V. (NL) 2008-11-06 US disclosed
US-20050245756-A1 Process for the preparation of enantiomerically enriched compounds DSM IP ASSETS B.V. (NL) 2005-11-03 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 (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-20050245756-A1 Process for the preparation of enantiomerically enriched compounds AR, NPR3, LMNA TTR 854/4885DPP4 4376/4885MAPT 3237/4885
US-20080275274-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED COMPOUNDS AR, TAC3, AOC3 TTR 2538/4885DPP4 3140/4885MAPT 4593/4885

“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.