SCHEMBL20063079

SCHEMBL20063079

O=C(OCC1c2ccccc2-c2ccccc21)N1CCCC(Cc2ccccc2)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.49
TACR3 P29371 1/20 0.48
CHRNB2 P17787 5/20 0.47
CHRNA4 P43681 5/20 0.47
RAB9A P51151 1/20 0.44
BCL9 O00512 1/20 0.43
CTNNB1 P35222 1/20 0.43
EED O75530 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
CHRNB4 P30926 4/20 0.41
CHRNA3 P32297 4/20 0.41
CCR3 P51677 1/20 0.41
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
FABP7 O15540 1/20 0.40
FABP5 Q01469 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
MAOB P27338 1/20 0.40
OPRD1 P41143 1/20 0.40

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
SCHEMBL1437435 0.87 CHRNB2 (0.44) CHRNB2CHRNA4BCL9CTNNB1CHRNB4
SCHEMBL20063081 0.86 L3MBTL1 (0.54) RAB9AL3MBTL1
SCHEMBL31080868 0.84 TACR3 (0.46) TACR3RAB9AL3MBTL1CCR3
SCHEMBL7822101 0.83 L3MBTL1 (0.60) HSD11B1TACR3RAB9AEEDL3MBTL1
SCHEMBL799721 0.82 FABP7 (0.46) RAB9AFABP7FABP5
SCHEMBL29516735 0.82 FABP7 (0.46) RAB9AFABP7FABP5
SCHEMBL29401030 0.82 FABP7 (0.46) RAB9AFABP7FABP5
SCHEMBL4362743 0.82 FABP7 (0.46) RAB9AFABP7FABP5
SCHEMBL118231 0.82 FABP7 (0.46) RAB9AFABP7FABP5
SCHEMBL29710361 0.82 FABP7 (0.46) RAB9AFABP7FABP5

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
US-20180105678-A1 CHEMICAL AMPLIFICATION IN SELF-STRENGTHENING MATERIALS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2018-04-19 US disclosed
US-20180105678-A1 CHEMICAL AMPLIFICATION IN SELF-STRENGTHENING MATERIALS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2018-04-19 US disclosed