SCHEMBL8635640

SCHEMBL8635640

COc1ccc(F)c(CC2CCN(C(C)=O)CC2)c1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.60
HTR1A P08908 2/20 0.60
MTNR1B P49286 3/20 0.56
PIK3CG P48736 2/20 0.52
DPP4 P27487 1/20 0.48
DPP7 Q9UHL4 1/20 0.48
CPS1 P31327 2/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL8638699 0.89 HTR1A (0.56) SLC6A4HTR1AMTNR1BCPS1MEN1
SCHEMBL8635447 0.89 MTNR1B (0.67) SLC6A4HTR1AMTNR1BCPS1MEN1
SCHEMBL8637331 0.89 MTNR1B (0.71) SLC6A4HTR1AMTNR1BCPS1KMT2A
SCHEMBL8633694 0.88 SLC6A4 (0.55) SLC6A4HTR1AMTNR1BCPS1MEN1
SCHEMBL8635354 0.88 SLC6A4 (0.55) SLC6A4HTR1AMTNR1BCPS1MEN1
SCHEMBL8636963 0.88 HTR1A (0.61) SLC6A4HTR1AMTNR1BMEN1POLB
SCHEMBL8637276 0.87 SLC6A4 (0.54) SLC6A4HTR1AMTNR1BCPS1MEN1
SCHEMBL8636883 0.87 MTNR1B (0.65) SLC6A4HTR1AMTNR1BCPS1KMT2A
SCHEMBL8635044 0.87 MTNR1B (0.65) SLC6A4HTR1AMTNR1BCPS1KMT2A
SCHEMBL8635648 0.86 SLC6A4 (0.53) SLC6A4HTR1AMTNR1BCPS1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718286-B1 3-Alkoxybenzylpiperidine derivatives as melatonergic agents BRISTOL MYERS SQUIBB CO (US) 1998-07-29 EP claimed
EP-0718286-A1 3-Alkoxybenzylpiperidine derivatives as melatonergic agents BRISTOL-MYERS SQUIBB COMPANY (US) 1996-06-26 EP claimed
JP-8208603-A None JP disclosed
JP-H08208603-A 3-ALKOXYBENZYLPIPERIDINE DERIVATIVE AS MELATONERGIC AGENT BRISTOL MYERS SQUIBB CO 1996-08-13 JP disclosed