SCHEMBL29511997

SCHEMBL29511997

CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc21

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 12/20 0.40
PDK2 Q15119 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
DHFR P00374 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31

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
SCHEMBL29390340 1.00 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL17693517 1.00 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL4084514 1.00 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL12640117 0.99 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL15138682 0.99 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL133504 0.99 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL15495964 0.99 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL12439592 0.97 SIGMAR1 (0.39) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL13907748 0.97 SIGMAR1 (0.39) SIGMAR1PDK2L3MBTL1DHFRMEN1
SCHEMBL12439779 0.97 SIGMAR1 (0.39) SIGMAR1PDK2L3MBTL1DHFRMEN1

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
US-20220112996-A1 JEWELRY AND GEM STONE LIGHTING SYSTEMS AND APPARATUSES AND METHOD MAKING AND USING SAME ASHLEY PAUL (US) 2022-04-14 US disclosed