SCHEMBL13336330

SCHEMBL13336330

Cn1cc(-c2cc(CN3CC(O)C3)cc(Nc3ncc4cc(Br)ccc4n3)c2)cn1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 6/20 0.44
▸ MAP4K3 Q8IVH8 1/20 0.44
▸ SYK P43405 7/20 0.37
▸ JUN P05412 2/20 0.36
▸ MAPK8 P45983 2/20 0.36
▸ MAPK10 P53779 2/20 0.36
▸ MAPK9 P45984 1/20 0.36
▸ MET P08581 1/20 0.36
▸ KDR P35968 2/20 0.36
▸ FGFR1 P11362 1/20 0.36
▸ FGFR2 P21802 1/20 0.36
▸ FGFR4 P22455 1/20 0.36
▸ FGFR3 P22607 1/20 0.36
▸ TTK P33981 1/20 0.36
▸ TYRO3 Q06418 1/20 0.35
▸ DDR2 Q16832 1/20 0.35

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
SCHEMBL1570584 0.93 MAP4K1 (0.44) MAP4K1MAP4K3SYKKDRFGFR1
SCHEMBL13336145 0.92 GRM2 (0.45) MAP4K1MAP4K3SYKKDRFGFR3
SCHEMBL1570714 0.90 WNT1 (0.41) MAP4K1MAP4K3JUNMAPK8MAPK10
SCHEMBL13336028 0.88 MAP4K1 (0.43) MAP4K1MAP4K3SYKJUNMAPK8
SCHEMBL13336180 0.87 MAP4K1 (0.44) MAP4K1MAP4K3JUNMAPK8MAPK10
SCHEMBL1571320 0.86 MAP4K1 (0.44) MAP4K1MAP4K3JUNMAPK8MAPK10
SCHEMBL13336142 0.86 TTK (0.44) MAP4K1MAP4K3JUNMAPK8MAPK10
SCHEMBL13362991 0.85 MAP4K1 (0.45) MAP4K1MAP4K3JUNMAPK8MAPK10
SCHEMBL13336174 0.85 GRM2 (0.45) MAP4K1MAP4K3SYKJUNMAPK8
SCHEMBL13336192 0.85 MAP4K1 (0.43) MAP4K1MAP4K3SYKJUNMAPK8

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
US-20100121052-A1 Novel compounds for treating proliferative diseases JAIN RAMA 2010-05-13 — — US disclosed
US-20100121052-A1 Novel compounds for treating proliferative diseases JAIN RAMA 2010-05-13 — — 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-20100121052-A1 Novel compounds for treating proliferative diseases PDK1, PDK2, PDK3 MAP4K1 112/4885MAP4K3 103/4885SYK 4070/4885

“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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