SCHEMBL2667474

SCHEMBL2667474

CCOC(=O)Cc1csc(NC(=O)c2cc(Oc3ccc(C(=O)N4CCN(C)CC4)cn3)nc(OC(C)C)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 3/20 0.49
HTT P42858 2/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 6/20 0.48
TSHR P16473 3/20 0.48
LMNA P02545 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
POLB P06746 2/20 0.47
NPSR1 Q6W5P4 1/20 0.44
GAA P10253 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TRPV4 Q9HBA0 1/20 0.42

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
SCHEMBL9070948 0.94 MAPT (0.53) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL9070915 0.94 MAPT (0.53) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL9070840 0.92 ALDH1A1 (0.54) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL2667481 0.92 F2 (0.42) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL9070994 0.91 MAPK1 (0.51) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL9070967 0.87 GCK (0.52) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL9070943 0.86 GCK (0.45) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL9070911 0.86 GCK (0.46) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL9070906 0.85 MAPT (0.56) MAPTCYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL9070817 0.85 ALDH1A1 (0.51) MAPTCYP1A2CYP2C9CYP2C19CYP3A4

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
WO-2009083553-A1 AZINE COMPOUNDS AS GLUCOKINASE ACTIVATORS RHEOSCIENCE A/S (DK) 2009-07-09 WO disclosed