SCHEMBL2494883

SCHEMBL2494883

CCOC(=O)c1cccc(N(CCOC)C(=O)OC(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
F2 P00734 2/20 0.41
MEP1B Q16820 1/20 0.41
GAA P10253 1/20 0.41
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL5281192 0.86 NPC1 (0.47) LMNAMAPTNPSR1ALDH1A1MAPK1
SCHEMBL2497481 0.86 F2 (0.45) MAPTALDH1A1NPC1RAB9AF2
SCHEMBL4872329 0.82 LMNA (0.41) LMNAMAPTNPSR1ALDH1A1MAPK1
SCHEMBL10145149 0.81 NPC1 (0.47) LMNAMAPTNPSR1ALDH1A1MAPK1
SCHEMBL9135663 0.78 MEP1B (0.41) LMNAMAPTNPSR1ALDH1A1MAPK1
SCHEMBL1242068 0.77 TSHR (0.40) LMNAMAPTNPSR1ALDH1A1MAPK1
SCHEMBL4844674 0.74 CASR (0.44) MAPTALDH1A1SMN1; SMN2RAB9ACYP4F2
SCHEMBL6387166 0.74 ALDH1A1 (0.51) LMNAMAPTNPSR1ALDH1A1SMN1; SMN2
SCHEMBL25522772 0.74 F2 (0.41) F2
SCHEMBL9320408 0.74 CA12 (0.40) LMNAMAPTNPSR1ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030489-B2 Ornithine derivative ASTELLAS PHARMA INC. (JP) 2011-10-04 US disclosed
US-8030489-B2 Ornithine derivative ASTELLAS PHARMA INC. (JP) 2011-10-04 US disclosed
US-20100216803-A1 ORNITHINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-08-26 US disclosed
US-20100216803-A1 ORNITHINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-08-26 US disclosed
CN-101641325-A Ornithine derivative ASTELLAS PHARMA INC JP 2010-02-03 CN disclosed
EP-2141147-A1 ORNITHINE DERIVATIVE Astellas Pharma Inc. (JP) 2010-01-06 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-20100216803-A1 ORNITHINE DERIVATIVE PTGER4, OXER1, ODC1 LMNA 4646/4885MAPT 4804/4885NPSR1 1318/4885

“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.