SCHEMBL20866691

SCHEMBL20866691

CCOC1(c2nc(C(=N)ON)c(N3CCOCC3)s2)CCC1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ GLA P06280 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TSHR P16473 1/20 0.31

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
SCHEMBL20866762 0.88 PIK3CA (0.30) —
SCHEMBL20866963 0.85 PIK3CD (0.30) SMN1; SMN2KDM4EALDH1A1GAAMAPT
SCHEMBL18394458 0.83 KDM4E (0.42) MAPK1SMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL20867257 0.82 SYK (0.31) —
SCHEMBL24612188 0.81 PIK3CD (0.30) MAPK1SMN1; SMN2KDM4EALDH1A1GAA
SCHEMBL20867295 0.79 — —
SCHEMBL24612210 0.70 FBP1 (0.31) KDM4E
SCHEMBL20866838 0.70 ATM (0.32) SMN1; SMN2KDM4EALDH1A1GAAMAPT
SCHEMBL24612293 0.69 ATM (0.31) SMN1; SMN2KDM4EALDH1A1GAAMAPT
SCHEMBL18394800 0.69 KDM4E (0.43) MAPK1KDM4EALDH1A1HPGDHSD17B10

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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