SCHEMBL8550256

SCHEMBL8550256

CCCC(C)N1CCC(c2coc3ccc(NC(=O)CCCCc4ccccc4)cc23)CC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
UBE2M P61081 19/20 0.49
DCUN1D1 Q96GG9 19/20 0.49
DRD2 P14416 1/20 0.43
HTR2A P28223 1/20 0.43
DRD3 P35462 1/20 0.43

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
Phenyl Propionic Acid SCHEMBL8703758 0.87 UBE2M (0.47) UBE2MDCUN1D1
SCHEMBL8550257 0.85 DRD2 (0.54) DRD2HTR2ADRD3
SCHEMBL7483467 0.84 HTR1D (0.62) UBE2MDCUN1D1
SCHEMBL8547528 0.84 UBE2M (0.49) UBE2MDCUN1D1
Phenyl Propionic Acid SCHEMBL8548350 0.83 UBE2M (0.46) UBE2MDCUN1D1
SCHEMBL8703766 0.80 UBE2M (0.44) UBE2MDCUN1D1
SCHEMBL8546763 0.77 HTR1D (0.45) DRD2HTR2ADRD3
SCHEMBL8548353 0.77 UBE2M (0.40) UBE2MDCUN1D1DRD2HTR2ADRD3
SCHEMBL8549309 0.76 UBE2M (0.39) UBE2MDCUN1D1DRD2
SCHEMBL8552426 0.76 RORC (0.49) DRD2HTR2ADRD3

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
US-5792763-A MIGRAINES; ANALGESICS; DISEASES LINKED TO DECREASED NEUROTRANMISSION OF SEROTONIN IN MAMMALS ELI LILLY AND COMPANY (US) 1998-08-11 US disclosed
WO-1998015545-A1 NEW SEROTONIN 5-HT1F AGONISTS ELI LILLY AND COMPANY (US) 1998-04-16 WO disclosed
EP-0835869-A2 New serotonin 5-HT1F agonists ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed