SCHEMBL5832270

SCHEMBL5832270

CCc1ccccc1[CH]CC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.40
GABRB2 P47870 3/20 0.40
MGLL Q99685 1/20 0.33
CTSB P07858 1/20 0.33
CYP24A1 Q07973 1/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CCR3 P51677 1/20 0.31
HCAR1 Q9BXC0 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAOA P21397 1/20 0.31
RIPK1 Q13546 1/20 0.31
PIM1 P11309 1/20 0.30
PIM3 Q86V86 1/20 0.30

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
SCHEMBL18242067 0.81 GABRA1 (0.42) GABRA1GABRB2MGLLCYP24A1MAPT
SCHEMBL5330754 0.75 GABRA1 (0.38) GABRA1GABRB2MGLLCYP24A1MAPT
SCHEMBL5892736 0.75 GABRA1 (0.43) GABRA1GABRB2MGLLCYP24A1MAPT
SCHEMBL8371947 0.75 GABRA1 (0.38) GABRA1GABRB2MGLLCYP24A1MAPT
SCHEMBL9541229 0.75 TSHR (0.46) MAPTNPSR1L3MBTL1MEN1LMNA
SCHEMBL1149697 0.73 GABRA1 (0.37) GABRA1GABRB2MGLLCYP24A1MAPT
SCHEMBL3314625 0.73 CHAT (0.47) GABRA1GABRB2MGLLCYP24A1MAPT
SCHEMBL1283641 0.73 GABRA1 (0.44) GABRA1GABRB2MGLLCYP24A1MAPT
SCHEMBL6546259 0.73 CHAT (0.47) GABRA1GABRB2MGLLCYP24A1MAPT
SCHEMBL15563320 0.72 POLB (0.37) GABRA1GABRB2MGLLTHRB

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-7009015-B2 Silane compounds with an ortho-substituted aromatic ring directly attached to the silicon atom useful as electron donors in Ziegler-Natta catalysts; makes propylene polymers with high degree of stereoblocks BASELL TECHNOLOGY COMPANY BV (NL) 2006-03-07 US disclosed