SCHEMBL3208398

SCHEMBL3208398

CC(C)(C)C(=N)c1cc2ccccc2cc1C1c2ccccc2-c2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
F2 P00734 1/20 0.31
PLG P00747 1/20 0.31
PLAU P00749 1/20 0.31
KLKB1 P03952 1/20 0.31
KLK1 P06870 1/20 0.31
PRSS1 P07477 1/20 0.31
POLB P06746 1/20 0.31
IDO1 P14902 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
SCHEMBL3201092 0.82 GPR3 (0.34) ALDH1A1KDM4ECYP2C9KMT2AHSD17B10
SCHEMBL3203825 0.79 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL3207517 0.77 PDK2 (0.35) SMN1; SMN2ALDH1A1KDM4EMEN1TP53
SCHEMBL3191412 0.77 CYP2D6 (0.35) SMN1; SMN2ALDH1A1KDM4EMEN1TP53
SCHEMBL3202549 0.76 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL3192348 0.76 KDM1A (0.36) ALDH1A1KDM4EMEN1CYP3A4MAPT
SCHEMBL3192568 0.74
SCHEMBL3190456 0.74 BCHE (0.37) SMN1; SMN2HTR2A
SCHEMBL3211330 0.72 NPC1 (0.37) ALDH1A1KDM4EMEN1MAPTCYP2C19
SCHEMBL3681402 0.67 NPC1 (0.40) SMN1; SMN2ALDH1A1KDM4EMEN1TP53

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