SCHEMBL6063387

SCHEMBL6063387

C=CCc1cccc2c1C(=O)c1ccc(N)c(CC=C)c1C2=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
MAOA P21397 3/20 0.41
MAOB P27338 1/20 0.41
ADORA2A P29274 5/20 0.39
CSNK1A1 P48729 2/20 0.39
CSNK1D P48730 2/20 0.39
CSNK1G1 Q9HCP0 2/20 0.39
FGR P09769 1/20 0.39
PIM1 P11309 1/20 0.39
DYRK1A Q13627 1/20 0.39
HIPK2 Q9H2X6 1/20 0.39
AKR1B1 P15121 1/20 0.37
MEN1 O00255 5/20 0.37
POLB P06746 5/20 0.37
KMT2A Q03164 5/20 0.37
ALDH1A1 P00352 5/20 0.37
L3MBTL1 Q9Y468 4/20 0.37
MAPT P10636 4/20 0.37

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
SCHEMBL728511 0.96 ELANE (0.46) ELANEGABRA1GABRB2MAOAMAOB
SCHEMBL9355397 0.87 MAOA (0.56) ELANEMAOAMAOBADORA2ACSNK1A1
SCHEMBL175397 0.80 GABRA1 (0.50) ELANEGABRA1GABRB2MAOAMAOB
SCHEMBL38652483 0.80 GABRA1 (0.50) ELANEGABRA1GABRB2MAOAMAOB
SCHEMBL28395338 0.79 GABRA1 (0.49) ELANEGABRA1GABRB2MAOAMAOB
Water SCHEMBL28566474 0.79 GABRA1 (0.49) ELANEGABRA1GABRB2MAOAMAOB
SCHEMBL10775937 0.77 GABRA1 (0.50) ELANEGABRA1GABRB2MAOAADORA2A
SCHEMBL7600157 0.76 ELANE (0.48) ELANEGABRA1GABRB2MAOAMAOB
SCHEMBL5420921 0.75 ADORA2A (0.43) ELANEGABRA1GABRB2MAOAMAOB
SCHEMBL8653935 0.72 MAOA (0.53) ELANEGABRA1GABRB2MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7087282-B2 Limited play optical storage medium, method for making the same GENERAL ELECTRIC COMPANY (US) 2006-08-08 US disclosed
US-20050014878-A1 Colored polymeric resin composition, article made therefrom, and method for making the same SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2005-01-20 US disclosed
US-20050013232-A1 Limited play optical storage medium, method for making the same SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2005-01-20 US disclosed