SCHEMBL25195217

SCHEMBL25195217

O=CC(F)(F)c1ncc(Br)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 1/20 0.37
▸ DYRK1A Q13627 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ AURKA O14965 1/20 0.32
▸ DAPK3 O43293 1/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ PRKD3 O94806 1/20 0.32
▸ MAP4K4 O95819 1/20 0.32
▸ PAK4 O96013 1/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ NTRK1 P04629 1/20 0.32
▸ FYN P06241 1/20 0.32
▸ RET P07949 1/20 0.32
▸ MET P08581 1/20 0.32
▸ PDGFRB P09619 1/20 0.32
▸ PIM1 P11309 1/20 0.32
▸ FGFR1 P11362 1/20 0.32
▸ PDGFRA P16234 1/20 0.32
▸ FLT1 P17948 1/20 0.32
▸ LTK P29376 1/20 0.32

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
SCHEMBL15674757 0.80 PLAU (0.42) PLAUDYRK1AALDH1A1KDM4ELMNA
SCHEMBL29989503 0.77 PLAU (0.40) PLAUALDH1A1METKDM4ELMNA
SCHEMBL16654525 0.77 PLAU (0.40) PLAUALDH1A1METKDM4ELMNA
SCHEMBL29268175 0.77 PLAU (0.40) PLAUALDH1A1METKDM4ELMNA
SCHEMBL21994706 0.77 PLAU (0.40) PLAUALDH1A1KDM4ELMNAMAPT
SCHEMBL19189346 0.75 PLAU (0.32) PLAUALDH1A1ATML3MBTL1
SCHEMBL16552187 0.72 PLAU (0.40) PLAUALDH1A1
SCHEMBL16540711 0.72 PLAU (0.40) PLAU
SCHEMBL18335087 0.72 PLAU (0.37) PLAUALDH1A1MAPTL3MBTL1
SCHEMBL21718921 0.72 PLAU (0.42) PLAUDYRK1AALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022164789-A9 TRICYCLIC COMPOUNDS USEFUL IN THE TREATMENT OF CANCER, AUTOIMMUNE AND INFLAMMATORY DISORDERS SCHRÖDINGER, INC. (US) 2023-05-25 — — WO disclosed
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