SCHEMBL22688665

SCHEMBL22688665

C1=CCCCN(C2CCCCCCCCCC2)CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 7/20 0.42
L3MBTL1 Q9Y468 5/20 0.42
HTR6 P50406 1/20 0.42
SLC18A3 Q16572 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MBTD1 Q05BQ5 5/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
PHGDH O43175 1/20 0.38
MGLL Q99685 1/20 0.38

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
SCHEMBL26630547 0.98 L3MBTL3 (0.41) L3MBTL3L3MBTL1HTR6SLC18A3MEN1
SCHEMBL22639458 0.86 L3MBTL3 (0.42) L3MBTL3L3MBTL1HTR6SLC18A3MEN1
Hydrochloric Acid SCHEMBL27218548 0.84 L3MBTL3 (0.41) L3MBTL3L3MBTL1HTR6SLC18A3MEN1
Hydrochloric Acid SCHEMBL27218545 0.84 L3MBTL3 (0.41) L3MBTL3L3MBTL1HTR6SLC18A3MEN1
SCHEMBL19312856 0.83 L3MBTL3 (0.46) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL27220553 0.83 KDM4E (0.35) L3MBTL3L3MBTL1HTR6SLC18A3MEN1
SCHEMBL24782761 0.83 HTR6 (0.54) L3MBTL3L3MBTL1HTR6SLC18A3MEN1
SCHEMBL21057384 0.83 HTR6 (0.54) L3MBTL3L3MBTL1HTR6SLC18A3MEN1
SCHEMBL22216666 0.83 HTR6 (0.54) L3MBTL3L3MBTL1HTR6SLC18A3MEN1
SCHEMBL1828721 0.83 HTR6 (0.54) L3MBTL3L3MBTL1HTR6SLC18A3MEN1

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
WO-2022111449-A1 PREPARATION METHOD FOR BTK DEGRADATION AGENT 四川海思科制药有限公司 2022-06-02 WO claimed
WO-2022111448-A1 METHOD FOR PREPARING BTK DEGRADING AGENT 四川海思科制药有限公司 2022-06-02 WO claimed
WO-2020232625-A1 PROCESS OF PREPARING DIAZOMETHANE 凯莱英医药集团(天津)股份有限公司 (CN) 2020-11-26 WO disclosed