SCHEMBL22447546

SCHEMBL22447546

COc1ncc(Br)cc1NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CCR4 P51679 4/20 0.59
▸ PIK3CA P42336 2/20 0.55
▸ MTOR P42345 2/20 0.55
▸ ALDH1A1 P00352 1/20 0.51
▸ METAP2 P50579 1/20 0.50
▸ PIK3CG P48736 1/20 0.49
▸ CCR2 P41597 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ S100A9 P06702 1/20 0.47
▸ MAP3K20 Q9NYL2 1/20 0.47
▸ PIK3CD O00329 2/20 0.47
▸ PIK3R1 P27986 1/20 0.47
▸ SLC10A2 Q12908 1/20 0.46
▸ SLC10A1 Q14973 1/20 0.46
▸ SLC10A6 Q3KNW5 1/20 0.46

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
SCHEMBL16551868 0.88 PIK3CA (0.55) PIK3CAMTORALDH1A1PIK3CGLMNA
SCHEMBL15556197 0.87 MTOR (0.55) PIK3CAMTORALDH1A1PIK3CGPIK3CD
SCHEMBL15648432 0.87 PIK3CG (0.49) CCR4PIK3CAMTORPIK3CGS100A9
SCHEMBL358926 0.87 PIK3CG (0.63) CCR4PIK3CAMTORPIK3CGS100A9
SCHEMBL29969873 0.86 CCR4 (0.64) CCR4PIK3CGMAP3K20PIK3CD
SCHEMBL21513796 0.86 CCR4 (0.64) CCR4PIK3CGMAP3K20PIK3CD
SCHEMBL28549695 0.86 PIK3CG (0.50) CCR4PIK3CAMTORPIK3CGS100A9
SCHEMBL22447721 0.85 GLO1 (0.46) CCR4PIK3CAMTORALDH1A1PIK3CG
Ammonia Solution, Strong SCHEMBL28564473 0.85 PIK3CG (0.49) CCR4PIK3CAMTORPIK3CGS100A9
SCHEMBL789641 0.84 MEN1 (0.52) PIK3CAALDH1A1PIK3CGLMNAS100A9

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-3712143-A1 QUINAZOLINONE COMPOUND AND APPLICATION THEREOF Luoxin Pharmaceutical (Shanghai) Co., Ltd. (CN) 2020-09-23 — — EP disclosed
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