SCHEMBL192522

SCHEMBL192522

CCc1nc2cnc3cccnc3c2n1CC(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
TP53 P04637 4/20 0.37
HTR2A P28223 2/20 0.37
HTR2B P41595 2/20 0.37
HTR2C P28335 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PDE10A Q9Y233 2/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
GPR4 P46093 1/20 0.35
POLB P06746 2/20 0.34
PABPC1 P11940 1/20 0.34
RECQL P46063 1/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GAA P10253 1/20 0.34
BRD4 O60885 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL1490884 0.89 TP53 (0.36) TP53HTR2AHTR2BHTR2CKDM4E
SCHEMBL3355085 0.88 TLR7 (0.45) KDM4EPDE4DTLR7
SCHEMBL191697 0.84 LMNA (0.39) TSHRTP53HTR2AHTR2BHTR2C
SCHEMBL8565615 0.82 TSHR (0.47) TSHRMAPK1HTR2AHTR2BKDM4E
SCHEMBL193507 0.80 TLR7 (0.49) HTR2AHTR2BPOLBLMNAHRH2
SCHEMBL4299553 0.80 PDE10A (0.38) TSHRMAPK1HTR2AHTR2BHTR2C
SCHEMBL4056414 0.79 ALDH1A1 (0.41) TSHRTP53KDM4EPOLBLMNA
SCHEMBL4302608 0.79 KDM4E (0.40) HTR2AHTR2BHTR2CKDM4EPDE10A
SCHEMBL192091 0.77 TSHR (0.38) TSHRMAPK1TP53HTR2AHTR2B
SCHEMBL841480 0.76 ALDH1A1 (0.36) MAPK1TP53HTR2AHTR2BHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1833827-B9 PROCESS FOR PREPARING 2-METHYL-1-(2-METHYLPROPYL)-1H-IMIDAZO[4,5-C][1,5]NAPHTHYRIDIN-4-AMINE MEDA AB (SE) 2012-01-04 EP claimed
EP-1833827-B1 PROCESS FOR PREPARING 2-METHYL-1-(2-METHYLPROPYL)-1H-IMIDAZO[4,5-C][1,5]NAPHTHYRIDIN-4-AMINE MEDA AB (SE) 2011-05-25 EP claimed