SCHEMBL3207517

SCHEMBL3207517

CN(C)c1ccc(C2c3ccccc3-c3ccccc32)c(C(=N)C(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.35
GPR3 P46089 1/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
F10 P00742 2/20 0.32
NPC1 O15118 2/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 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
SCHEMBL3192866 0.81 NPC1 (0.31) NPC1MAPTSMN1; SMN2LMNANPSR1
SCHEMBL3203111 0.81 MAPK1 (0.39) PDK2GPR3ALDH1A1TSHRF10
SCHEMBL3201092 0.81 GPR3 (0.34) GPR3ALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL3204869 0.78 NPC1 (0.30) NPC1MAPTSMN1; SMN2LMNANPSR1
SCHEMBL3200019 0.78 P2RX4 (0.32) ALDH1A1TSHR
SCHEMBL3208398 0.77 SMN1; SMN2 (0.32) GPR3ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL3213680 0.77 KDM4E (0.36) PDK2GPR3ALDH1A1TSHRNPC1
SCHEMBL3202608 0.77 SLC10A2 (0.36) PDK2GPR3F10
SCHEMBL3200758 0.76 F10 (0.30) F10
SCHEMBL3679790 0.73 NPC1 (0.36) PDK2ALDH1A1TSHRNPC1MAPT

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