SCHEMBL3205293

SCHEMBL3205293

CC(C)(C)NC(C)(C)c1ccccc1C1c2ccccc2-c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
ATM Q13315 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
NCOR2 Q9Y618 1/20 0.31
PPIA P62937 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
SCHEMBL3213298 0.79 NPSR1 (0.35) GPR3HTR2AHTR2CHTR2BKMT2A
SCHEMBL3208634 0.76
SCHEMBL3201759 0.74 ACHE (0.50) HTR2AHTR2CHTR2BKMT2AMEN1
SCHEMBL3202824 0.73 MEN1 (0.35) KMT2APOLBMEN1
SCHEMBL3211000 0.72
Hydrochloric Acid SCHEMBL3216590 0.70 GPR3 (0.33) GPR3HTR2AHTR2CHTR2BPOLB
SCHEMBL3202697 0.70 SIGMAR1 (0.33) HTR2AHTR2CHTR2B
SCHEMBL27660089 0.69 CA1 (0.33) GPR3HTR2AHTR2CHTR2BKMT2A
SCHEMBL3216599 0.68 GPR3 (0.32) GPR3HTR2APOLB
Hydrochloric Acid SCHEMBL3258008 0.68 GPR3 (0.35) GPR3HTR2A

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-7671226-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-02 US disclosed
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
US-7439379-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL CO., LTD. (JP) 2008-10-21 US disclosed