SCHEMBL14573269

SCHEMBL14573269

CC1(C)OB(c2cccc(NC(=O)NCCCN3CCOCC3)c2)OC1(C)C

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.58
MAPT P10636 1/20 0.55
PRMT3 O60678 1/20 0.52
EPHX2 P34913 6/20 0.51
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
PDGFRB P09619 1/20 0.49
FLT1 P17948 1/20 0.49
KDR P35968 1/20 0.49
MCHR1 Q99705 1/20 0.48
ALOX15 P16050 1/20 0.48
LMNA P02545 2/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47
TACR2 P21452 2/20 0.47
CNR1 P21554 1/20 0.47

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
SCHEMBL12517550 0.82 TSHR (0.47) EPHX2LMNAPOLB
SCHEMBL18343293 0.81 ALDH1A1 (0.64) SMN1; SMN2LMNAPOLB
SCHEMBL27332191 0.81 EPHX1 (0.47) SMN1; SMN2MAPTEPHX2PDGFRBKDR
SCHEMBL3323121 0.79 MAPT (0.44) SMN1; SMN2MAPTCYP3A4CYP2D6CYP2C19
SCHEMBL16581991 0.79 PDGFRB (0.44) SMN1; SMN2MAPTPDGFRBKDRLMNA
SCHEMBL15639503 0.78 NPC1 (0.60) SMN1; SMN2MAPTCYP2C19TP53
SCHEMBL488233 0.78 MEN1 (0.40) EPHX2CYP3A4LMNAPOLB
SCHEMBL3322268 0.77 LPL (0.45) SMN1; SMN2MAPTPDGFRBKDR
SCHEMBL3321460 0.76 PRMT5 (0.46) EPHX2CYP3A4CYP2C19LMNA
SCHEMBL3322078 0.74 LIPG (0.61) SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7186832-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-03-06 US disclosed
US-7186832-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-03-06 US disclosed
US-7157460-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-01-02 US disclosed
US-7157460-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-01-02 US disclosed