SCHEMBL25575441

SCHEMBL25575441

CN[C@H](C)CN1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ANPEP P15144 1/20 0.41
ERAP2 Q6P179 1/20 0.41
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
PRMT8 Q9NR22 1/20 0.39
MAPT P10636 3/20 0.38
ATM Q13315 2/20 0.38
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
HRH3 Q9Y5N1 3/20 0.36
CHRM2 P08172 2/20 0.36
ADRA2B P18089 2/20 0.36
DRD3 P35462 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
HSD17B10 Q99714 1/20 0.35
LMNA P02545 1/20 0.35
LTA4H P09960 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL17424103 1.00 MEN1 (0.46) MEN1KMT2AANPEPERAP2CARM1
SCHEMBL9511251 0.98 KMT2A (0.42) MEN1KMT2AANPEPERAP2CARM1
SCHEMBL7342935 0.98 KMT2A (0.42) MEN1KMT2AANPEPERAP2CARM1
SCHEMBL9511248 0.98 KMT2A (0.42) MEN1KMT2AANPEPERAP2CARM1
SCHEMBL17424098 0.81 MEN1 (0.46) MEN1KMT2AANPEPERAP2CARM1
SCHEMBL26724624 0.81 MEN1 (0.46) MEN1KMT2AANPEPERAP2CARM1
SCHEMBL8337259 0.79 GAA (0.39) MAPTALDH1A1SIGMAR1
SCHEMBL27015205 0.78 KMT2A (0.42) MEN1KMT2AANPEPERAP2CARM1
SCHEMBL13817508 0.77 MEN1 (0.43) MEN1KMT2AANPEPERAP2CARM1
SCHEMBL8594059 0.77 CARM1 (0.46) CARM1PRMT6PRMT8MAPTALDH1A1

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
WO-2023098730-A1 COMPOUND CONTAINING CYCLOALKYL OR HALOALKYL 正大天晴药业集团股份有限公司 2023-06-08 WO disclosed