SCHEMBL5619038

SCHEMBL5619038

CNc1nccn2c(-c3ccc(NC(=O)NCc4ccc(F)cc4)cc3)cnc12

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 4/20 0.57
▸ CYP3A4 P08684 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ NAMPT P43490 8/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ AKT1 P31749 1/20 0.44
▸ IDO1 P14902 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 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
SCHEMBL5618589 0.91 TTK (0.58) TTKCYP3A4NAMPTNPC1
SCHEMBL5618446 0.91 TTK (0.57) TTKPOLBRAB9ANAMPTNPC1
SCHEMBL5618516 0.90 TTK (0.59) TTKNAMPT
SCHEMBL5619090 0.89 TTK (0.54) TTKCYP3A4ALDH1A1NAMPTIDO1
SCHEMBL5619165 0.89 TTK (0.55) TTKPOLBRAB9ANAMPTNPC1
SCHEMBL5618058 0.87 TTK (0.53) TTKNAMPTIDO1
SCHEMBL5618729 0.86 TTK (0.56) TTK
SCHEMBL5617963 0.85 TTK (0.55) TTKRAB9ANAMPTIDO1MEN1
SCHEMBL5619180 0.85 MAPKAPK5 (0.57) TTKNAMPT
SCHEMBL5618496 0.84 TTK (0.54) 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 5 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-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-20050009832-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN, INC. 2005-01-13 — — 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 (1 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 TTK 69/4885CYP3A4 891/4885ALDH1A1 2826/4885

“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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