SCHEMBL9234562

SCHEMBL9234562

C#Cc1c(F)c(F)c(F)c2c1c(=O)c(OC(=O)O)cn2C1CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ GSK3B P49841 8/20 0.36
▸ TOP2A P11388 7/20 0.36
▸ TOP2B Q02880 7/20 0.36
▸ CACNA1F O60840 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ CACNA1D Q01668 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ CACNA1S Q13698 1/20 0.35
▸ CACNA1C Q13936 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
SCHEMBL6216986 0.87 MEN1 (0.46) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL9233707 0.84 TOP2A (0.37) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL6216507 0.83 TOP2A (0.39) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL6213897 0.82 GSK3B (0.49) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL9047018 0.82 TOP2A (0.42) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL8131150 0.82 MEN1 (0.39) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL7524708 0.80 TOP2A (0.44) GSK3BTOP2ATOP2BPOLBKCNH2
SCHEMBL8327191 0.80 MEN1 (0.37) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL9416465 0.79 TOP2A (0.42) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL10377463 0.76 TOP2A (0.40) MEN1KMT2AGSK3BTOP2ATOP2B

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
EP-0671391-A1 5-Vinyl- and 5-ethinyl-quinolinone- and -naphthyridone-carboxylic acids BAYER AG (DE) 1995-09-13 — — EP claimed
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