SCHEMBL23064484

SCHEMBL23064484

O=CC1CCCN1c1ccccc1C1CC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.38
ADRA1B P35368 1/20 0.38
GAA P10253 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NOTUM Q6P988 1/20 0.35
MGLL Q99685 1/20 0.35
HCAR1 Q9BXC0 1/20 0.35
AR P10275 4/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
CHRNA7 P36544 1/20 0.34
NOS1 P29475 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
UCHL1 P09936 1/20 0.33

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
SCHEMBL27592344 0.83 NOTUM (0.42) HTR1AADRA1BGAAKDM4EALDH1A1
SCHEMBL6937201 0.76 NOS1 (0.40) HTR1AADRA1BGAAKDM4EALDH1A1
SCHEMBL28526319 0.75 PDK2 (0.48) HTR1AMEN1KMT2AARSLC6A2
SCHEMBL23064587 0.75 FFAR1 (0.46) KMT2A
SCHEMBL28256158 0.75 DRD2 (0.45) ADRA1BGAAKDM4EALDH1A1MAPT
SCHEMBL24775518 0.72 GAA (0.36) HTR1AADRA1BGAAKDM4EALDH1A1
SCHEMBL17479641 0.72 MYC (0.47) GAAKDM4EALDH1A1MAPTMEN1
SCHEMBL27960754 0.71 MEN1 (0.33) GAAKDM4EALDH1A1MAPTMEN1
SCHEMBL28001815 0.71 HTR6 (0.44) KDM4EMAPTKMT2A
SCHEMBL28468815 0.70 FFAR1 (0.41) GAAALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117683029-A Bcl-2 inhibitors 百济神州有限公司 2024-03-12 CN disclosed
CN-117430601-A Bcl-2 inhibitors 百济神州有限公司 2024-01-23 CN disclosed
CN-112437772-B Bcl-2 inhibitors 百济神州有限公司 2023-11-21 CN disclosed
EP-3788042-A1 BCL-2 INHIBITORS BeiGene, Ltd. (KY) 2021-03-10 EP disclosed
CN-112437772-A Bcl-2 inhibitors 百济神州有限公司 2021-03-02 CN disclosed