SCHEMBL4264345

SCHEMBL4264345

CCC(=O)NCCC1CC(C)c2ccc(OC)cc21

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 14/20 0.66
NQO2 P16083 13/20 0.66
MTNR1B P49286 13/20 0.66

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
SCHEMBL4258217 0.91 MTNR1A (0.67) MTNR1ANQO2MTNR1B
SCHEMBL4260242 0.88 MTNR1A (0.65) MTNR1ANQO2MTNR1B
SCHEMBL4259220 0.87 MTNR1A (0.50) MTNR1ANQO2MTNR1B
SCHEMBL4264832 0.84 MTNR1A (0.54) MTNR1ANQO2MTNR1B
SCHEMBL8888049 0.80 MTNR1A (0.65) MTNR1ANQO2MTNR1B
SCHEMBL4687318 0.80 MTNR1A (1.00) MTNR1ANQO2MTNR1B
SCHEMBL135601 0.80 MTNR1A (1.00) MTNR1ANQO2MTNR1B
SCHEMBL135600 0.80 MTNR1A (1.00) MTNR1ANQO2MTNR1B
SCHEMBL136496 0.79 MTNR1A (0.64) MTNR1ANQO2MTNR1B
SCHEMBL16167706 0.78 MTNR1A (0.42) MTNR1ANQO2MTNR1B

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
WO-2009053443-A2 INDANE COMPOUNDS FERRER INTERNACIONAL S.A. (ES) 2009-04-30 WO claimed
WO-2009053443-A2 INDANE COMPOUNDS FERRER INTERNACIONAL S.A. (ES) 2009-04-30 WO disclosed