SCHEMBL5408035

SCHEMBL5408035

c1ccc(-c2cnc3c(NCCN4CCOCC4)nccn23)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 4/20 0.69
▸ ADORA3 P0DMS8 2/20 0.55
▸ TLR9 Q9NR96 2/20 0.50
▸ TTK P33981 2/20 0.49
▸ CYP3A4 P08684 4/20 0.49
▸ LMNA P02545 4/20 0.49
▸ CYP1A2 P05177 3/20 0.49
▸ CYP2D6 P10635 3/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ CHRM1 P11229 1/20 0.49
▸ CNR1 P21554 1/20 0.49
▸ ACHE P22303 1/20 0.49
▸ HTR2B P41595 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ CLK4 Q9HAZ1 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48

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
SCHEMBL8246200 0.85 FLT3 (0.57) FLT3ADORA3TTK
SCHEMBL5408732 0.83 ADORA3 (0.59) FLT3ADORA3CYP3A4LMNACYP1A2
SCHEMBL9940984 0.83 TTK (0.75) FLT3ADORA3TTK
SCHEMBL5618861 0.82 FLT3 (0.52) FLT3ADORA3CYP3A4LMNACYP1A2
SCHEMBL12271994 0.82 FLT3 (1.00) FLT3ADORA3LMNA
SCHEMBL12272218 0.82 FLT3 (0.68) FLT3ADORA3HIF1ANPC1ALDH1A1
SCHEMBL5408560 0.79 TTK (0.65) FLT3ADORA3TTK
SCHEMBL12271835 0.78 FLT3 (0.68) FLT3ADORA3CYP3A4LMNACYP1A2
SCHEMBL12273036 0.78 FLT3 (0.67) FLT3ADORA3TTKCYP3A4CYP1A2
SCHEMBL9941056 0.77 TTK (0.72) TTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050009832-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN, INC. 2005-01-13 — — US claimed
US-20040220189-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhbitors SUGEN, INC. 2004-11-04 — — US claimed
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-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
US-20050009832-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN, INC. 2005-01-13 — — US disclosed
US-20040220189-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhbitors SUGEN, INC. 2004-11-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050009832-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors MAP3K8, MAP3K2, MAP3K5 FLT3 216/4885ADORA3 2912/4885TLR9 2751/4885
US-20040220189-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhbitors MAP3K8, MAP4K4, MAP3K2 FLT3 215/4885ADORA3 2383/4885TLR9 2098/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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