SCHEMBL18345263

SCHEMBL18345263

CC(C)(C)OC(=O)N1CCCC(c2nc(Br)c3c(N)nccn23)C1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TNK2 Q07912 2/20 0.60
▸ BTK Q06187 9/20 0.46
▸ FGFR4 P22455 7/20 0.44
▸ FGFR1 P11362 4/20 0.44
▸ FGFR3 P22607 2/20 0.44
▸ FGFR2 P21802 1/20 0.42
▸ HPGDS O60760 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
SCHEMBL16748869 1.00 TNK2 (0.60) TNK2BTKFGFR4FGFR1FGFR3
SCHEMBL18099743 0.91 TNK2 (0.58) TNK2BTKFGFR4FGFR1FGFR3
SCHEMBL18099747 0.89 TNK2 (0.61) TNK2BTKFGFR4FGFR1FGFR3
SCHEMBL20962359 0.89 BTK (0.51) TNK2BTKFGFR4FGFR1FGFR3
SCHEMBL16748868 0.89 TNK2 (0.51) TNK2BTKHPGDS
SCHEMBL28633843 0.89 TNK2 (0.60) TNK2BTKFGFR4FGFR1FGFR3
SCHEMBL28643796 0.89 TNK2 (0.60) TNK2BTKFGFR4FGFR1FGFR3
SCHEMBL18345372 0.89 TNK2 (0.51) TNK2BTKHPGDS
SCHEMBL20962382 0.87 TNK2 (0.46) TNK2BTKFGFR4FGFR1FGFR3
SCHEMBL20962197 0.87 BTK (0.49) TNK2BTKFGFR4FGFR1FGFR3

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-3313839-A1 TYROSINE KINASE INHIBITORS Principia Biopharma Inc. (US) 2018-05-02 — — EP disclosed
WO-2016210165-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2016-12-29 — — WO disclosed
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