SCHEMBL38652201

SCHEMBL38652201

CC(C)(C)OC(=O)N1CCCC1c1cc(C=O)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.42
LMNA P02545 4/20 0.41
NPSR1 Q6W5P4 3/20 0.41
TSHR P16473 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
HTT P42858 1/20 0.40
NTRK1 P04629 4/20 0.40
POLB P06746 1/20 0.40
APP P05067 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
DRD2 P14416 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
SLC6A2 P23975 1/20 0.39

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
SCHEMBL38652022 0.87 NTRK1 (0.37) LMNANPSR1TSHRALDH1A1MEN1
SCHEMBL932475 0.86 NTRK1 (0.50) RIPK1NTRK1APPHTR1AADRA2A
SCHEMBL29525364 0.86 NTRK1 (0.50) RIPK1NTRK1APPHTR1AADRA2A
SCHEMBL932474 0.86 NTRK1 (0.50) RIPK1NTRK1APPHTR1AADRA2A
SCHEMBL30148073 0.86 NTRK1 (0.50) RIPK1NTRK1APPHTR1AADRA2A
SCHEMBL38652323 0.86 NTRK1 (0.37) NTRK1GHSR
SCHEMBL38652145 0.84 NR1H2 (0.36) NTRK1GHSR
SCHEMBL38652192 0.84 NR1H2 (0.36) NTRK1GHSR
SCHEMBL38652321 0.84 NR1H2 (0.36) NTRK1GHSR
SCHEMBL38652267 0.83 OPRK1 (0.45) LMNANPSR1TSHRALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122010910-A Biazacycloalkane Menin-MLL protein inhibitor, pharmaceutical composition and application thereof 赛诺哈勃药业(成都)有限公司 2026-05-12 CN disclosed