SCHEMBL7535899

SCHEMBL7535899

COC(=O)CCc1cc(I)c(OC)cc1Cc1cc(CCC(=O)OC)c(Cc2cc(CCC(=O)OC)c(Cc3cc(CCC(=O)O)c(CO[Si](C)(C)C(C)(C)C)cc3OC)cc2OC)cc1OC

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.37
MTNR1B P49286 4/20 0.37
POLB P06746 1/20 0.32
PDE4D Q08499 1/20 0.31
DPP4 P27487 1/20 0.31
PPARD Q03181 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL7536742 0.96 MTNR1A (0.39) MTNR1AMTNR1BPDE4D
SCHEMBL7530080 0.96 MTNR1A (0.39) MTNR1AMTNR1BPDE4D
SCHEMBL7533095 0.96 MTNR1A (0.39) MTNR1AMTNR1BPDE4D
SCHEMBL7530400 0.90 MTNR1A (0.36) MTNR1AMTNR1BPDE4D
SCHEMBL7534945 0.90 MTNR1A (0.38) MTNR1AMTNR1BPDE4D
SCHEMBL7532277 0.90 MTNR1A (0.38) MTNR1AMTNR1BPDE4D
SCHEMBL7530899 0.90 MTNR1A (0.38) MTNR1AMTNR1BPDE4D
SCHEMBL8959275 0.79 HMGCR (0.41) POLBPDE4DDPP4
SCHEMBL7532530 0.78 BACE1 (0.36) MTNR1AMTNR1BPOLB
SCHEMBL7531040 0.78 HMGCR (0.38) MTNR1AMTNR1BPOLBPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0585371-B1 AROMATIC OLIGOMERIC COMPOUNDS USEFUL AS MIMICS OF BIOACTIVE MACROMOLECULES RHONE POULENC RORER INTERNAT H (US) 2002-04-17 EP disclosed
US-5571506-A AROMATIC ALDEHYDE OLIGOMERS FOR TREATMENT OF CARDIOVASCULAR DISORDERS, BONE METABOLISM, ANTILIPEMIC AGENTS AND GASTROINTESTINAL DISORDERS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-11-05 US disclosed
WO-1993000357-A1 THERAPEUTIC POLYPEPTIDES BASED ON VON WILLEBRAND FACTOR RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1993-01-07 WO disclosed