SCHEMBL10340372

SCHEMBL10340372

COc1ccc2[nH]cc3c2c1CC(NC(=O)c1ccccc1)C3

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.74
MTNR1B P49286 5/20 0.74
MCOLN2 Q8IZK6 1/20 0.41
MCOLN1 Q9GZU1 1/20 0.41
FABP5 Q01469 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
SCHEMBL8409987 0.85 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL10447045 0.82 MTNR1A (0.70) MTNR1AMTNR1BMCOLN2MCOLN1
Hydrochloric Acid SCHEMBL27339226 0.81 MTNR1A (0.68) MTNR1AMTNR1BMCOLN2MCOLN1
SCHEMBL10340399 0.81 MTNR1A (0.64) MTNR1AMTNR1B
SCHEMBL11036691 0.79 MTNR1A (0.71) MTNR1AMTNR1B
SCHEMBL9531900 0.78 MTNR1A (0.60) MTNR1AMTNR1B
SCHEMBL10340217 0.77 MTNR1A (0.69) MTNR1AMTNR1B
SCHEMBL9532979 0.76 MTNR1A (0.64) MTNR1AMTNR1B
SCHEMBL10340388 0.76 MTNR1A (0.67) MTNR1AMTNR1B
SCHEMBL9532235 0.74 MTNR1A (0.53) MTNR1AMTNR1B

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
EP-0162695-B1 6-OXYGENATED-1,3,,4,5-TETRAHYDROBENZ(CD)INDOL-4-AMINES SMITHKLINE BEECHAM CORPORATION (US) 1990-01-17 EP disclosed
EP-0162695-A1 6-Oxygenated-1,3,,4,5-Tetrahydrobenz(cd)indol-4-amines SMITHKLINE BEECHAM CORPORATION (US) 1985-11-27 EP disclosed