SCHEMBL22794822

SCHEMBL22794822

CCN1[C@@H]2CC[C@H]1CN(C(=O)CCCC(C)C)C2

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
NPC1 O15118 1/20 0.38
CHRNB2 P17787 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
CHRNB3 Q05901 1/20 0.36
CHRNA6 Q15825 1/20 0.36
GNAI3 P08754 7/20 0.35
GNAO1 P09471 7/20 0.35
GNAI1 P63096 7/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
PREP P48147 2/20 0.33
FOS P01100 1/20 0.33
JUN P05412 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ATM Q13315 1/20 0.32

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
SCHEMBL25123575 0.88 NPC1 (0.38) MEN1KMT2APOLBMAPTNPC1
SCHEMBL25914467 0.88 NPC1 (0.38) MEN1KMT2APOLBMAPTNPC1
SCHEMBL25877388 0.88 NPC1 (0.38) MEN1KMT2APOLBMAPTNPC1
SCHEMBL23696466 0.88 NPC1 (0.38) MEN1KMT2APOLBMAPTNPC1
SCHEMBL22856170 0.85 MEN1 (0.51) MEN1KMT2APOLBMAPTNPC1
SCHEMBL24508295 0.82 NPC1 (0.34) MEN1KMT2APOLBMAPTNPC1
SCHEMBL24511299 0.82 FAAH (0.35) MEN1KMT2APOLBMAPTNPC1
SCHEMBL23945313 0.81 GNAI3 (0.40) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL23806469 0.80 MEN1 (0.47) MEN1KMT2APOLBMAPTNPC1
SCHEMBL24508742 0.80 MEN1 (0.47) MEN1KMT2APOLBMAPTNPC1

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-2020251971-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed