SCHEMBL13515770

SCHEMBL13515770

CC(Cl)N1CCN(CCC(=O)O)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.47
▸ CYP1A2 P05177 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ LMNA P02545 1/20 0.37
▸ APEX1 P27695 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ SLC6A9 P48067 1/20 0.34
▸ PRCP P42785 2/20 0.33
▸ PAOX Q6QHF9 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ HRH1 P35367 2/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ HRH2 P25021 1/20 0.33

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
SCHEMBL13745049 0.85 GLA (0.50) GLACYP1A2SMN1; SMN2MAPK1LMNA
Hydrochloric Acid SCHEMBL2949425 0.83 GLA (0.53) GLACYP1A2SMN1; SMN2MAPK1LMNA
SCHEMBL24911981 0.80 GLA (0.46) GLACYP1A2SMN1; SMN2MAPK1LMNA
SCHEMBL7027263 0.79 GLA (0.67) GLACYP1A2SMN1; SMN2MAPK1LMNA
SCHEMBL3973280 0.79 GLA (0.67) GLACYP1A2SMN1; SMN2MAPK1LMNA
SCHEMBL6536452 0.79 GLA (0.67) GLACYP1A2SMN1; SMN2MAPK1LMNA
SCHEMBL1069692 0.79 — —
Isobutanol SCHEMBL9242794 0.79 GLA (0.52) GLACYP1A2SMN1; SMN2MAPK1APEX1
Propane SCHEMBL1995071 0.78 GLA (0.59) GLACYP1A2SMN1; SMN2MAPK1LMNA
Ammonia Solution, Strong SCHEMBL9352555 0.77 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1489078-B1 BENZOFURAN DERIVATIVE MITSUBISHI TANABE PHARMA CORP (JP) 2010-01-06 — — EP disclosed
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