SCHEMBL28895871

SCHEMBL28895871

OC(c1ccccc1)c1ccc(C2=CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.54
NAMPT P43490 1/20 0.54
DRD4 P21917 6/20 0.51
SIGMAR1 Q99720 2/20 0.50
DRD2 P14416 6/20 0.49
DRD3 P35462 4/20 0.49
HTR1A P08908 2/20 0.49
HTT P42858 2/20 0.49
HTR2A P28223 1/20 0.49
MAPK1 P28482 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GAA P10253 1/20 0.46
CNR1 P21554 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
OPRM1 P35372 1/20 0.45
OPRK1 P41145 1/20 0.45

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
SCHEMBL6585625 0.84 DRD4 (0.63) HDAC4NAMPTDRD4SIGMAR1DRD2
SCHEMBL2395932 0.84 DRD4 (0.67) HDAC4NAMPTDRD4SIGMAR1DRD2
SCHEMBL8441289 0.82 KDM4E (0.50) DRD4SIGMAR1DRD2DRD3HTR1A
SCHEMBL2395803 0.81 LMNA (0.60) HDAC4NAMPTDRD4SIGMAR1DRD2
SCHEMBL10287534 0.81 SIGMAR1 (0.71) HDAC4NAMPTDRD4SIGMAR1DRD2
SCHEMBL29188191 0.81 DRD4 (0.67) HDAC4NAMPTDRD4SIGMAR1DRD2
SCHEMBL2392338 0.80 DRD4 (0.56) HDAC4NAMPTDRD4SIGMAR1DRD2
SCHEMBL2395917 0.80 MAPK1 (0.69) HDAC4NAMPTDRD4SIGMAR1DRD2
SCHEMBL13959654 0.80 DRD4 (0.56) HDAC4NAMPTDRD4SIGMAR1DRD2
SCHEMBL2582694 0.80 HDAC4 (0.58) HDAC4NAMPTDRD4SIGMAR1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112724070-B Preparation method of alpha, alpha-diphenyl-4-piperidinemethanol 南京方生和医药科技有限公司 2022-11-25 CN claimed
CN-112724070-A Preparation method of alpha, alpha-diphenyl-4-piperidinemethanol 南京方生和医药科技有限公司 2021-04-30 CN claimed
CN-112724070-B Preparation method of alpha, alpha-diphenyl-4-piperidinemethanol 南京方生和医药科技有限公司 2022-11-25 CN disclosed
CN-112724070-B Preparation method of alpha, alpha-diphenyl-4-piperidinemethanol 南京方生和医药科技有限公司 2022-11-25 CN disclosed
CN-112724070-A Preparation method of alpha, alpha-diphenyl-4-piperidinemethanol 南京方生和医药科技有限公司 2021-04-30 CN disclosed
CN-112724070-A Preparation method of alpha, alpha-diphenyl-4-piperidinemethanol 南京方生和医药科技有限公司 2021-04-30 CN disclosed