SCHEMBL20866963

SCHEMBL20866963

CC1(c2nc(C(=N)ON)c(N3CCOCC3)s2)CCC1

nearest known ligand 0.30

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL24612188 0.96 PIK3CD (0.30) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL20867257 0.88 SYK (0.31) —
SCHEMBL20866762 0.87 PIK3CA (0.30) PIK3CA
SCHEMBL20866691 0.85 MAPK1 (0.31) KDM4EALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL20867295 0.84 — —
SCHEMBL24612210 0.75 FBP1 (0.31) KDM4E
SCHEMBL20866838 0.75 ATM (0.32) PIK3CDPIK3CAPIK3CBKDM4EALDH1A1
SCHEMBL24612293 0.74 ATM (0.31) KDM4EALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL20867306 0.73 ATM (0.31) —
SCHEMBL20866960 0.72 ATM (0.32) PIK3CDPIK3CAPIK3CBKDM4EALDH1A1

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
WO-2019067864-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2019-04-04 — — WO disclosed
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