SCHEMBL6637708

SCHEMBL6637708

CC(=O)NCC1Cc2cccc3c(Cl)ccc(c23)C1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 14/20 0.49
MTNR1B P49286 13/20 0.49
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
CCR3 P51677 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
SCHEMBL7281450 0.78 MTNR1A (0.68) MTNR1AMTNR1B
SCHEMBL6640319 0.74 SLC6A2 (0.43) KDM4EALDH1A1HPGD
SCHEMBL29477258 0.69 MTNR1A (0.55) MTNR1AMTNR1B
SCHEMBL6638097 0.69 MTNR1A (0.67) MTNR1AMTNR1B
SCHEMBL7273633 0.68 MTNR1A (0.50) MTNR1AMTNR1BHPGD
Hydrochloric Acid SCHEMBL10617650 0.67 HTR2A (0.46)
SCHEMBL8881567 0.67 MTNR1A (0.47) MTNR1AMTNR1BALDH1A1
SCHEMBL6632742 0.66 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL19658437 0.66 MTNR1A (0.65) MTNR1AMTNR1B
SCHEMBL19322908 0.66 MTNR1A (1.00) 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-1047664-B1 NOVEL TRICYCLIC COMPOUNDS, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2004-05-19 EP disclosed
US-6423870-B1 ANTICOAGULANTS; CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS LES LABORATOIRES SERVIER (FR) 2002-07-23 US disclosed