SCHEMBL9852229

SCHEMBL9852229

O=C(NC1CCN(Cc2ccc(OCc3ccc(Cl)cc3)cc2)CC1)c1ccccc1

nearest known ligand 0.84

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 4/20 0.75
MCHR1 Q99705 2/20 0.67
DRD4 P21917 2/20 0.66
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
TMEM97 Q5BJF2 1/20 0.62
DRD2 P14416 1/20 0.61
SIGMAR1 Q99720 1/20 0.60
UTS2R Q9UKP6 1/20 0.60

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
SCHEMBL16233177 0.91 SLC6A5 (0.84) SLC6A5MCHR1DRD4MEN1KMT2A
SCHEMBL9870172 0.90 MEN1 (0.78) MCHR1DRD4MEN1KMT2ATMEM97
SCHEMBL9870566 0.87 MEN1 (0.73) MCHR1DRD4MEN1KMT2ATMEM97
SCHEMBL9871439 0.84 UTS2R (0.69) SLC6A5MCHR1DRD4MEN1KMT2A
SCHEMBL9872559 0.83 DRD4 (0.78) MCHR1DRD4MEN1KMT2ASIGMAR1
SCHEMBL694949 0.83 SIGMAR1 (0.82) MCHR1DRD4MEN1KMT2ATMEM97
SCHEMBL17946118 0.81 ADIPOR2 (0.88) MCHR1DRD4MEN1KMT2ASIGMAR1
SCHEMBL61848 0.80 TMEM97 (0.83) MCHR1DRD4MEN1KMT2ATMEM97
SCHEMBL7218171 0.80 TMEM97 (0.74) SLC6A5MCHR1DRD4MEN1KMT2A
SCHEMBL1477287 0.79 SLC6A5 (0.65) SLC6A5MEN1KMT2A

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-0416581-A1 Substituted N-benzylpiperidine amides G.D. Searle & Co. (US) 1991-03-13 EP claimed
US-5028616-A Antiarrhythmia Agents G. D. SEARLE & CO. (US) 1991-07-02 US disclosed