SCHEMBL30023029

SCHEMBL30023029

O=C(O)c1cc2ccc(C3=CCOCC3)cc2c(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ IKBKE Q14164 2/20 0.50
▸ TBK1 Q9UHD2 2/20 0.50
▸ PIK3CA P42336 6/20 0.40
▸ PIK3CD O00329 4/20 0.40
▸ PIK3CB P42338 2/20 0.40
▸ PIK3CG P48736 2/20 0.40
▸ FABP7 O15540 3/20 0.39
▸ GSK3B P49841 1/20 0.37
▸ FABP5 Q01469 2/20 0.37
▸ FABP3 P05413 1/20 0.37
▸ HTR1D P28221 1/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ MTOR P42345 2/20 0.36
▸ SUV39H2 Q9H5I1 2/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL23930140 0.86 IKBKE (0.43) IKBKETBK1PIK3CAPIK3CDPIK3CB
SCHEMBL30023884 0.86 IKBKE (0.43) IKBKETBK1PIK3CAPIK3CDPIK3CB
SCHEMBL28901595 0.78 IKBKE (0.44) IKBKETBK1PIK3CAPIK3CDPIK3CB
SCHEMBL31704722 0.74 PIK3CD (0.46) IKBKETBK1PIK3CAPIK3CDPIK3CB
SCHEMBL30023002 0.74 IKBKE (0.48) IKBKETBK1PIK3CAPIK3CDFABP7
SCHEMBL420951 0.70 IKBKE (0.44) IKBKETBK1PIK3CAPIK3CDFABP7
SCHEMBL1572799 0.70 GSK3B (0.59) IKBKETBK1FABP7GSK3B
SCHEMBL31510526 0.70 IKBKE (0.51) IKBKETBK1PIK3CAPIK3CDPIK3CB
SCHEMBL21033161 0.68 PTGS1 (0.43) IKBKETBK1PIK3CAPIK3CDFABP7
SCHEMBL8651066 0.68 KMT2A (0.56) IKBKETBK1FABP7FABP5FABP3

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
CN-115397822-A CBP/EP300 inhibitors and uses thereof 南京药石科技股份有限公司 2022-11-25 — — CN disclosed
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