SCHEMBL6929339

SCHEMBL6929339

O=C(CCOCCCl)CC(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALDH1A1 P00352 4/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HTT P42858 1/20 0.40
CDC25B P30305 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL4507548 0.87 ALDH1A1 (0.50) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1
SCHEMBL5413781 0.80 ALDH1A1 (0.59) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1
SCHEMBL1011103 0.79 ALDH1A1 (0.68) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1
SCHEMBL27462425 0.79 ALDH1A1 (0.58) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1
SCHEMBL7350746 0.79 ALDH1A1 (0.58) ALDH1A1MAPK1L3MBTL1KMT2ATDP1
SCHEMBL3105598 0.78 PPID (0.47) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1
SCHEMBL22064095 0.78 LMNA (0.48) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1
SCHEMBL4915672 0.77 ALDH1A1 (0.56) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1
SCHEMBL27655876 0.77 ALDH1A1 (0.56) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1
SCHEMBL16368837 0.77 ALDH1A1 (0.59) LMNASMN1; SMN2ALDH1A1MAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610717-B2 Selectively inhibits action of N-type calcium channel; treatment of ischemic cerebrovascular disorders caused by cerebral infarction or intracerebral bleeding, Alzheimer's disease, AIDS related dementia, Parkinson's disease AJINOMOTO CO., INC. (JP) 2003-08-26 US disclosed
US-20020193605-A1 New dihydropyridine derivatives AJINOMOTO CO. INC (JP) 2002-12-19 US disclosed
EP-1191022-A1 NOVEL DIHYDROPYRIDINE DERIVATIVE Ajinomoto Co., Inc. (JP) 2002-03-27 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-20020193605-A1 New dihydropyridine derivatives CACNA1B, CACNA1D, CACNA1C LMNA 1651/4885SMN1; SMN2 398/4885ALDH1A1 1372/4885

“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.