SCHEMBL24612293

SCHEMBL24612293

CC(C)(c1nc(C(=N)ON)c(N2CCOCC2)s1)N1CCOCC1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ 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
SCHEMBL20866838 0.87 ATM (0.32) ATMLMNAKDM4EALDH1A1GAA
SCHEMBL20867306 0.85 ATM (0.31) ATMLMNA
SCHEMBL20866960 0.84 ATM (0.32) ATMKDM4EALDH1A1GAAMAPT
SCHEMBL18395657 0.79 KDM4E (0.47) ATMKDM4EALDH1A1GAAMAPT
SCHEMBL18412926 0.77 KDM4E (0.38) ATMLMNAKDM4EALDH1A1GAA
SCHEMBL24612210 0.75 FBP1 (0.31) KDM4E
SCHEMBL24612188 0.75 PIK3CD (0.30) KDM4EALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL20866963 0.74 PIK3CD (0.30) KDM4EALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL18394895 0.73 KDM4E (0.39) LMNAKDM4EALDH1A1GAAMAPT
SCHEMBL20867257 0.71 SYK (0.31) —

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-3324977-B1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS ENANTA PHARM INC (US) 2022-07-13 — — EP disclosed
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