SCHEMBL24215441

SCHEMBL24215441

COCCN1CCN(c2ncc(N)cc2F)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 3/20 0.45
▸ MTOR P42345 3/20 0.45
▸ MAP4K4 O95819 2/20 0.43
▸ ATR Q13535 2/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ TLR7 Q9NYK1 2/20 0.38
▸ KDR P35968 1/20 0.38
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ACHE P22303 2/20 0.36
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL30411894 1.00 PIK3CA (0.45) PIK3CAMTORMAP4K4ATRADORA2A
SCHEMBL23623107 0.85 PIK3CA (0.48) PIK3CAMTORMAP4K4TLR7KDR
SCHEMBL23623068 0.84 PIK3CA (0.45) PIK3CAMTORMAP4K4MAPTALDH1A1
SCHEMBL23623610 0.80 POLB (0.38) MTORADORA2AMAPTALDH1A1LMNA
SCHEMBL14070979 0.80 SMN1; SMN2 (0.50) MAPTKDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL29046099 0.79 ALDH1A1 (0.47) PIK3CAMTORATRMAPTKDM4E
SCHEMBL30412634 0.79 ALDH1A1 (0.47) PIK3CAMTORATRMAPTKDM4E
SCHEMBL23622940 0.77 SCN10A (0.39) PIK3CAMTORATRMAPTALDH1A1
SCHEMBL16391106 0.76 MAPT (0.54) MAP4K4ADORA2AMAPTKDM4EALDH1A1
SCHEMBL24215560 0.76 CASP1 (0.37) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116528862-A Compounds and compositions for the treatment of diseases associated with STING activity 艾福姆德尤股份有限公司 2023-08-01 — — CN disclosed
EP-4182028-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM Due, Inc. (US) 2023-05-24 — — EP disclosed
WO-2022015957-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2022-01-20 — — WO disclosed
WO-2022015957-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2022-01-20 — — WO disclosed
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