SCHEMBL28078161

SCHEMBL28078161

CC[Si](N)(CC)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.50
HTR7 P34969 1/20 0.41
HTR2B P41595 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
DRD2 P14416 2/20 0.37
DRD4 P21917 2/20 0.37
DRD3 P35462 2/20 0.37
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ACHE P22303 3/20 0.35
BCHE P06276 1/20 0.35
PGR P06401 1/20 0.34
GABRP O00591 1/20 0.33

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
SCHEMBL7583444 0.83 PNMT (0.49) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL6673983 0.83 PNMT (0.49) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL27555872 0.82 PNMT (0.47) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL27574872 0.81 PNMT (0.50) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL7577803 0.81 PNMT (0.46) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL8086440 0.80 PNMT (0.49) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL7197595 0.78 PNMT (0.44) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL6063638 0.78 PNMT (0.50) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL5981385 0.78 PNMT (0.49) PNMTHTR7HTR2BNPC1RAB9A
SCHEMBL6671922 0.78 PNMT (0.49) PNMTHTR7HTR2BNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105859924-B A kind of sub- training alkene process catalyst and its preparation 亚培烯科技(杭州)有限公司 2018-07-13 CN disclosed
CN-105859924-A Apalene process catalyst and preparation method thereof 魏东初 2016-08-17 CN disclosed