SCHEMBL7678390

SCHEMBL7678390

O=[C]N1CCN(c2cnccn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SORD Q00796 1/20 0.48
▸ KDM4E B2RXH2 5/20 0.47
▸ LMNA P02545 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ SLC6A7 Q99884 1/20 0.46
▸ GPR119 Q8TDV5 2/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL15887427 0.79 SORD (0.51) SORDKDM4ELMNAL3MBTL1ALDH1A1
SCHEMBL2320496 0.77 SORD (0.51) SORDKDM4ELMNAL3MBTL1ALDH1A1
SCHEMBL31014265 0.77 SORD (0.51) SORDKDM4ELMNAL3MBTL1ALDH1A1
SCHEMBL18228513 0.77 SORD (0.51) SORDKDM4ELMNAL3MBTL1ALDH1A1
SCHEMBL2074813 0.76 LMNA (0.54) SORDKDM4ELMNAL3MBTL1ALDH1A1
SCHEMBL2074811 0.76 SORD (0.51) SORDKDM4ELMNAL3MBTL1ALDH1A1
SCHEMBL7678393 0.75 L3MBTL1 (0.50) SORDKDM4ELMNAL3MBTL1ALDH1A1
SCHEMBL5525542 0.75 ALDH1A1 (0.56) KDM4EALDH1A1
SCHEMBL27723124 0.75 SLC6A7 (0.59) SORDKDM4ELMNAL3MBTL1ALDH1A1
SCHEMBL468382 0.75 SORD (0.50) SORDKDM4ELMNAL3MBTL1ALDH1A1

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
US-6342503-B1 ANTIDEPRESSANTS, EATING DISORDERS DUPONT PHARMACEUTICALS COMPANY 2002-01-29 — — US disclosed
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