SCHEMBL23930140

SCHEMBL23930140

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKE Q14164 1/20 0.43
▸ TBK1 Q9UHD2 1/20 0.43
▸ PIK3CD O00329 6/20 0.40
▸ PIK3CA P42336 6/20 0.40
▸ PIK3CB P42338 5/20 0.40
▸ PIK3CG P48736 5/20 0.40
▸ SUV39H2 Q9H5I1 2/20 0.38
▸ SCN9A Q15858 1/20 0.37
▸ HTR1D P28221 1/20 0.37
▸ LCK P06239 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ PIK3R1 P27986 3/20 0.36
▸ NOTUM Q6P988 1/20 0.36
▸ GSK3B P49841 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ PDE3B Q13370 1/20 0.34
▸ PDE3A Q14432 1/20 0.34
▸ WNT3A P56704 1/20 0.34
▸ TNKS2 Q9H2K2 1/20 0.34
▸ FABP7 O15540 1/20 0.34

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
SCHEMBL30023884 1.00 IKBKE (0.43) IKBKETBK1PIK3CDPIK3CAPIK3CB
SCHEMBL30023029 0.86 IKBKE (0.50) IKBKETBK1PIK3CDPIK3CAPIK3CB
SCHEMBL27143486 0.80 LCK (0.43) IKBKETBK1PIK3CDPIK3CAPIK3CB
SCHEMBL31413391 0.80 LCK (0.43) IKBKETBK1PIK3CDPIK3CAPIK3CB
SCHEMBL30023414 0.78 IKBKE (0.41) IKBKETBK1PIK3CDPIK3CAPIK3CB
SCHEMBL31706474 0.77 PIK3CD (0.44) PIK3CDPIK3CAPIK3CBPIK3CGSCN9A
SCHEMBL23930271 0.76 ALDH1A1 (0.38) PIK3CDPIK3CAPIK3CBPIK3CGLCK
SCHEMBL25136506 0.76 PIK3CD (0.38) PIK3CDPIK3CAPIK3CBPIK3CGSUV39H2
SCHEMBL24107476 0.74 MAPK1 (0.47) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL30263383 0.74 MAPK1 (0.47) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1

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
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
WO-2021213521-A1 CBP/EP300 INHIBITOR AND USE THEREOF 南京药石科技股份有限公司 (CN) 2021-10-28 — — WO disclosed
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