SCHEMBL3862809

SCHEMBL3862809

CCCCN([Ti])Cc1c(C2=CC(CN(C)C)=CC2)ccc2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
NCEH1 Q6PIU2 1/20 0.33
HTR1B P28222 2/20 0.31
BCHE P06276 1/20 0.31
CNR1 P21554 2/20 0.31
HTR1D P28221 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
Hydrochloric Acid SCHEMBL3263811 0.89 KDM4E (0.37) KDM4EMAPTTDP1KMT2AMEN1
SCHEMBL3866398 0.83 KDM4E (0.39) KDM4EMAPTTDP1KMT2A
SCHEMBL3199340 0.82 KDM4E (0.36) KDM4EMAPTTDP1KMT2AMEN1
SCHEMBL3213391 0.81 KDM4E (0.46) KDM4EMAPTTDP1KMT2AMEN1
SCHEMBL3862812 0.80 KDM4E (0.34) KDM4EMAPTTDP1NCEH1CNR1
Hydrochloric Acid SCHEMBL3263814 0.79 KDM4E (0.34) KDM4EMAPTTDP1NCEH1CNR1
Hydrochloric Acid SCHEMBL3259708 0.78 KDM4E (0.39) KDM4EMAPTTDP1KMT2A
Hydrochloric Acid SCHEMBL3258491 0.78 KDM4E (0.39) KDM4EMAPTTDP1KMT2A
Hydrochloric Acid SCHEMBL3189712 0.78 KDM4E (0.40) KDM4EMAPTTDP1KMT2AMEN1
SCHEMBL3192246 0.77 KDM4E (0.34) KDM4EMAPTTDP1KMT2AMEN1

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
EP-1426379-B1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME SUMITOMO CHEMICAL CO (JP) 2009-11-11 EP disclosed