SCHEMBL6154002

SCHEMBL6154002

CC(=O)O[C@H](CBr)CNC(=O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
SYK P43405 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
CTSK P43235 5/20 0.44
CTSS P25774 5/20 0.44
CTSL P07711 4/20 0.44
CTSB P07858 3/20 0.44
MAPT P10636 1/20 0.43
SLC1A3 P43003 1/20 0.43
SLC1A1 P43005 1/20 0.43

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
SCHEMBL6154004 1.00 HTT (0.50) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL6153937 0.87 ALDH1A1 (0.50) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL6154638 0.87 ALDH1A1 (0.50) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL6153940 0.87 ALDH1A1 (0.50) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL2141987 0.81 ALDH1A1 (0.53) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL2141982 0.81 ALDH1A1 (0.53) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL6153690 0.79 LMNA (0.55) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL29410261 0.79 LMNA (0.55) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL6153694 0.79 LMNA (0.55) HTTALDH1A1LMNASMN1; SMN2SYK
SCHEMBL29410259 0.79 LMNA (0.55) HTTLMNASMN1; SMN2SYKL3MBTL1

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-20050215801-A1 Process for preparation of optically active 1-substituted amino-2,3-epoxypropanes, intermediates for synthesis thereof and process for preparation of the intermediates KANEKA CORPORATION (JP) 2005-09-29 US disclosed
EP-1553093-A1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE 1-SUBSTITUTED AMINO-2,3-EPOXYPROPANES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND PROCESS FOR PREPARATION OF THE INTERMEDIATES KANEKA CORPORATION (JP) 2005-07-13 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 (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-20050215801-A1 Process for preparation of optically active 1-substituted amino-2,3-epoxypropanes, intermediates for synthesis thereof and process for preparation of the intermediates OXER1, RCC2, CBR3 HTT 3955/4885ALDH1A1 538/4885LMNA 3686/4885

“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.