SCHEMBL686641

SCHEMBL686641

C1=C(N2Cc3ccccc3C2)c2ccccc2C1.[LiH]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 2/20 0.42
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 4/20 0.38
RAB9A P51151 6/20 0.36
NPC1 O15118 4/20 0.36
TP53 P04637 1/20 0.36
BACE1 P56817 1/20 0.36
KDM4E B2RXH2 2/20 0.35
HTR6 P50406 1/20 0.35
PKM P14618 1/20 0.33
EED O75530 1/20 0.33
LMNA P02545 1/20 0.33
FGB P02675 1/20 0.33
MAPK1 P28482 1/20 0.33
RECQL P46063 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL687468 0.98 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2HPGDKMT2AMEN1
Lithium SCHEMBL686643 0.96 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2HPGDKMT2AMEN1
SCHEMBL688041 0.88 EED (0.46) SMN1; SMN2KMT2AMEN1MAPTRAB9A
SCHEMBL687814 0.85 EED (0.47) SMN1; SMN2KMT2AMEN1MAPTRAB9A
Lithium SCHEMBL688043 0.84 EED (0.46) SMN1; SMN2KMT2AMEN1MAPTRAB9A
SCHEMBL6092486 0.80 APAF1 (0.43) ALDH1A1SMN1; SMN2HPGDGAAMAPT
SCHEMBL30832650 0.80 APAF1 (0.43) ALDH1A1SMN1; SMN2HPGDGAAMAPT
SCHEMBL6904573 0.78 APAF1 (0.46) ALDH1A1SMN1; SMN2HPGDGAAMAPT
SCHEMBL8244044 0.77 DRD2 (0.48) KMT2AMAPTLMNAMAPK1EGFR
SCHEMBL8796353 0.76 MEN1 (0.49) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242471-B1 SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES LLC (US) 2012-02-29 EP disclosed
CN-1495188-A Substituted tetrels metal complex, catalyst and olefin polymerization method 2004-05-12 CN disclosed
CN-1409729-A Substituted group 4 metal complexes, catalysts and olefin polymerization processes DOW GLOBAL TECHNOLOGY CO (US) 2003-04-09 CN disclosed
US-6515155-B1 Group 4 metal complexes of the constrained geometry type, catalysts derived therefrom and polymerization processes using the same, characterized by a nitrogen containing aliphatic or cycloaliphatic moiety that is substituted with one or more DOW GLOBAL TECHNOLOGIES INC. 2003-02-04 US disclosed
EP-1242471-A1 SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 2002-09-25 EP disclosed
WO-2001042315-A1 SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2001-06-14 WO disclosed