SCHEMBL7061165

SCHEMBL7061165

C(#CN(Oc1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.41
MAPT P10636 3/20 0.33
FFAR1 O14842 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
THPO P40225 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GRM5 P41594 2/20 0.31
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
KMT2A Q03164 2/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
GAA P10253 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
SCHEMBL621536 0.74 L3MBTL1 (0.39) MAPTL3MBTL1ATMTDP1NPSR1
SCHEMBL2923198 0.70 APP (0.52) APPMAPTFFAR1CYP1A2CYP3A4
SCHEMBL18570099 0.69 LTA4H (0.43) MAPTL3MBTL1CYP1A2CYP3A4CYP2C9
SCHEMBL9417468 0.66 LTA4H (0.39) MAPTL3MBTL1CYP1A2CYP3A4CYP2C9
SCHEMBL2552447 0.63 APP (0.55) APPMAPTCYP1A2CYP3A4CYP2C9
Diphenylacetylene SCHEMBL68254 0.62 APP (1.00) APPMAPTFFAR1CYP1A2CYP3A4
Diphenylacetylene SCHEMBL29188592 0.62 APP (1.00) APPMAPTFFAR1CYP1A2CYP3A4
Diphenylacetylene SCHEMBL960609 0.62 APP (1.00) APPMAPTFFAR1CYP1A2CYP3A4
SCHEMBL7867520 0.61 CA4 (0.42) MAPTL3MBTL1ATMTDP1MEN1
SCHEMBL11032763 0.61 L3MBTL1 (0.43) MAPTL3MBTL1ATMTDP1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0966493-A4 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMW SCIENT IND RES ORG (AU) 2004-04-21 EP disclosed
US-6344523-B1 POLYIMIDES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION OF CAMPBELL (AU) 2002-02-05 US disclosed
EP-0966493-A1 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1999-12-29 EP disclosed
WO-1998040422-A1 REDUCED TEMPERATURE CURING OF ACETYLENIC POLYMERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1998-09-17 WO disclosed