SCHEMBL13336170

SCHEMBL13336170

Cn1cc(-c2cc(Nc3ncc4cc(Br)ccc4n3)cc(OCCO)c2)cn1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 3/20 0.42
▸ MAP4K3 Q8IVH8 1/20 0.42
▸ FGFR3 P22607 7/20 0.41
▸ KDR P35968 6/20 0.41
▸ FGFR1 P11362 6/20 0.41
▸ FGFR2 P21802 5/20 0.41
▸ FGFR4 P22455 5/20 0.41
▸ FLT3 P36888 2/20 0.41
▸ BRAF P15056 5/20 0.40
▸ TTK P33981 2/20 0.39
▸ CCNA2 P20248 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ JUN P05412 2/20 0.38
▸ MAPK8 P45983 2/20 0.38
▸ MAPK10 P53779 2/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ JAK3 P52333 1/20 0.38
▸ MAPK9 P45984 1/20 0.38

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
SCHEMBL13336277 0.89 RIPK2 (0.42) MAP4K1MAP4K3FGFR3KDRFGFR1
SCHEMBL1571686 0.88 MAP4K1 (0.40) MAP4K1MAP4K3FGFR3KDRFGFR1
SCHEMBL1571377 0.87 BRAF (0.43) MAP4K1MAP4K3FGFR3FGFR1FGFR2
SCHEMBL13336194 0.86 MAP4K1 (0.41) MAP4K1MAP4K3FGFR3KDRFGFR1
SCHEMBL1571320 0.86 MAP4K1 (0.44) MAP4K1MAP4K3BRAFTTKCCNA2
SCHEMBL1571589 0.85 GSK3B (0.42) MAP4K1MAP4K3BRAF
SCHEMBL12671430 0.84 MAP4K1 (0.46) MAP4K1MAP4K3FGFR3KDRBRAF
SCHEMBL1571511 0.84 ACACB (0.40) MAP4K1MAP4K3BRAF
SCHEMBL13336175 0.84 JAK1 (0.41) MAP4K1MAP4K3FLT3TTKCCNA2
SCHEMBL13336197 0.83 MAP4K1 (0.43) MAP4K1MAP4K3FGFR3KDRFLT3

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 3 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
WO-2009153313-A1 2 -ARYLAMINOQUINAZOLINES FOR TREATING PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2009-12-23 — — WO 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 103/4885FGFR3 691/4885

“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.

Send feedback